data_1kqq_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 1kqq _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 ' 9' ' ' GLN . . . . . 0.586 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 19.8 mm-40 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.18 -49.38 74.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.952 -1.092 . . . . 0.0 109.83 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.6 mtmm -60.74 -35.63 76.84 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.035 -1.041 . . . . 0.0 108.911 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -66.35 -49.99 65.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.55 -0.719 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.28 -35.86 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 120.771 -1.206 . . . . 0.0 108.901 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.572 ' NH1' ' OE2' ' A' ' 18' ' ' GLU . 0.5 OUTLIER -54.83 -40.47 69.61 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.409 ' HA ' HE21 ' A' ' 15' ' ' GLN . 7.4 mm-40 -59.76 -31.64 69.84 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.1 mt -70.77 -37.31 73.35 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.354 -0.841 . . . . 0.0 111.129 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.524 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.3 m-85 -79.25 -33.0 43.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.487 -1.383 . . . . 0.0 110.329 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.572 ' OE2' ' NH1' ' A' ' 14' ' ' ARG . 97.8 mt-10 -66.24 -30.06 70.43 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.915 -1.115 . . . . 0.0 110.45 -178.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.475 ' C ' ' O ' ' A' ' 18' ' ' GLU . 23.9 mt -36.17 -40.39 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 O-C-N 121.719 -0.613 . . . . 0.0 110.687 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -171.68 164.6 6.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.654 -1.279 . . . . 0.0 110.766 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -90.79 65.6 5.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.748 -0.595 . . . . 0.0 110.103 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.569 ' OD1' ' N ' ' A' ' 25' ' ' ARG . 10.8 t70 -112.42 95.72 32.75 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.351 -0.843 . . . . 0.0 108.847 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.46 -41.72 35.92 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.369 2.046 . . . . 0.0 112.217 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -60.06 -41.0 91.42 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.208 -0.932 . . . . 0.0 108.486 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.574 HH22 ' CG ' ' A' ' 55' ' ' ASP . 67.4 ttt180 -61.32 -38.96 88.77 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.631 -0.668 . . . . 0.0 110.134 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -59.88 -48.89 79.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.191 -0.943 . . . . 0.0 109.41 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -53.46 -38.49 63.63 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.51 -0.744 . . . . 0.0 109.367 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -64.55 -61.25 2.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.976 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.481 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 49.1 mt -55.47 -46.67 76.82 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.334 -0.854 . . . . 0.0 108.781 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.524 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 82.7 m-20 -62.0 -49.11 77.36 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.219 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.471 ' O ' ' OG ' ' A' ' 34' ' ' SER . 53.3 t0 -66.7 -42.44 86.42 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -57.89 -50.37 73.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.103 -0.998 . . . . 0.0 110.192 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 46.6 m-85 -61.19 -35.21 76.54 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 118.064 -1.454 . . . . 0.0 107.54 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 31' ' ' ASP . 32.3 p -70.76 -53.62 14.78 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.716 0.77 . . . . 0.0 109.371 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.458 ' CD1' ' NZ ' ' A' ' 38' ' ' LYS . 43.9 t80 -57.4 -44.02 84.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.701 -0.624 . . . . 0.0 110.402 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mmm -56.71 -34.46 67.48 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.365 -0.834 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.423 ' C ' ' OE1' ' A' ' 37' ' ' GLN . 5.2 tm0? -54.43 -41.68 69.65 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.458 ' NZ ' ' CD1' ' A' ' 35' ' ' PHE . 6.6 ttpm? -67.07 -40.09 86.97 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.498 -0.751 . . . . 0.0 109.578 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.8 mmm180 -64.41 -30.76 71.8 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.811 -0.556 . . . . 0.0 109.913 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.24 0.71 65.23 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.1 p -117.17 85.25 18.46 Favored Pre-proline 0 N--CA 1.488 1.44 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -83.47 145.97 12.03 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.537 2.158 . . . . 0.0 111.281 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 15.7 mt -86.9 104.81 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 120.921 -1.112 . . . . 0.0 110.475 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.606 ' O ' ' NE ' ' A' ' 45' ' ' ARG . 79.5 m-20 -85.34 -10.26 56.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.606 ' NE ' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -156.21 117.54 3.86 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.475 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mt -70.82 138.23 85.44 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 120.463 -1.398 . . . . 0.0 108.949 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -52.76 133.93 52.36 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 N-CA-C 109.391 -1.042 . . . . 0.0 109.391 176.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.8 mt -105.14 149.36 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.967 -1.083 . . . . 0.0 109.775 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.41 ' SD ' ' CD2' ' A' ' 87' ' ' LEU . 22.9 mtt -142.23 120.9 12.59 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.45 41.79 7.22 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 70.9 mttt 60.45 27.13 16.74 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.322 0.582 . . . . 0.0 109.597 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 86.6 p -137.33 154.67 50.01 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 109.417 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 m -69.31 147.22 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 109.687 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.555 ' CD2' ' OE1' ' A' ' 101' ' ' GLN . 57.4 tp -84.36 127.89 34.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.345 -0.847 . . . . 0.0 109.539 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.574 ' CG ' HH22 ' A' ' 25' ' ' ARG . 4.6 m-20 -66.31 90.33 0.15 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.377 -0.827 . . . . 0.0 109.575 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.7 mt -55.57 -25.27 37.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.976 -1.078 . . . . 0.0 109.601 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -76.3 -54.64 6.49 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.227 -0.921 . . . . 0.0 111.636 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.31 -37.5 83.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.778 -1.201 . . . . 0.0 109.739 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.8 -44.72 90.86 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.983 -1.073 . . . . 0.0 108.278 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.415 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.6 t80 -56.73 -68.06 0.25 Allowed 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.73 -0.606 . . . . 0.0 109.848 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -42.7 -39.87 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.371 -0.831 . . . . 0.0 111.415 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.416 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 6.1 mt -71.24 -44.35 65.49 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 118.144 -1.422 . . . . 0.0 107.628 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.406 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.4 t -59.16 -46.11 92.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.282 -0.886 . . . . 0.0 109.848 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.415 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -67.98 -35.83 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.711 -1.243 . . . . 0.0 108.414 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.418 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.75 -25.82 20.53 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.985 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.59 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.6 mpt_? -91.3 -2.9 57.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.564 -1.335 . . . . 0.0 109.109 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.31 20.55 56.77 Favored Glycine 0 N--CA 1.492 2.42 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.227 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.97 132.64 3.09 Favored Glycine 0 N--CA 1.5 2.914 0 O-C-N 120.503 -1.586 . . . . 0.0 111.407 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tp -49.85 -38.35 34.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.645 -0.915 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.15 -42.79 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.912 -1.117 . . . . 0.0 110.814 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -56.34 -39.08 72.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.776 -1.203 . . . . 0.0 109.218 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 49.5 t -63.34 -43.59 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.756 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.441 HG21 HD12 ' A' ' 73' ' ' ILE . 83.6 mt -66.04 -57.16 11.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 O-C-N 120.834 -1.166 . . . . 0.0 110.284 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.416 HD22 ' CB ' ' A' ' 125' ' ' ALA . 13.5 m120 -57.1 -42.85 81.54 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.268 -0.895 . . . . 0.0 110.28 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -94.44 -7.31 41.82 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.924 . . . . 0.0 111.292 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.6 mttm 58.8 58.33 3.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.299 -0.876 . . . . 0.0 110.589 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.0 mt -91.81 13.82 17.23 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.779 -1.2 . . . . 0.0 108.51 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' GLN . 84.0 m95 -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.372 -0.83 . . . . 0.0 108.777 178.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.466 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 9.4 mp0 -50.15 -40.18 45.68 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 120.618 -1.302 . . . . 0.0 108.342 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.59 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.3 mt-10 -68.51 -40.59 80.77 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.083 -1.011 . . . . 0.0 108.302 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.35 -52.15 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.07 -53.61 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.519 -0.738 . . . . 0.0 109.354 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 86' ' ' HIS . 26.1 mmtp -72.01 -39.59 69.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.0 109.888 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -50.63 -31.57 22.82 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.63 -6.83 51.57 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.439 -1.036 . . . . 0.0 109.127 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 83' ' ' LYS . 41.9 m-70 65.86 41.12 3.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.776 -0.578 . . . . 0.0 109.921 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' CD2' ' SD ' ' A' ' 49' ' ' MET . 12.0 mt -73.02 147.78 88.62 Favored Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.405 -0.81 . . . . 0.0 109.339 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.9 Cg_endo -73.29 141.47 32.17 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 C-N-CA 122.353 2.035 . . . . 0.0 112.368 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.7 p -62.25 -0.78 0.6 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.833 . . . . 0.0 109.987 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.453 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.0 p -65.79 -23.51 66.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.09 -1.006 . . . . 0.0 109.934 -178.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.439 HD12 HG23 ' A' ' 91' ' ' ILE . 80.2 mt -98.3 105.96 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 120.96 -1.088 . . . . 0.0 109.224 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 50.6 p -76.19 -25.66 55.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 109.054 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.1 m -96.05 34.64 1.53 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.546 -0.721 . . . . 0.0 109.259 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.29 -64.43 0.95 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.43 -51.68 25.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.315 -0.865 . . . . 0.0 109.269 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.88 -43.15 90.84 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.801 -1.187 . . . . 0.0 108.954 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.7 m -60.11 -40.14 88.63 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.085 -1.009 . . . . 0.0 108.426 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.55 -46.54 63.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.664 -0.647 . . . . 0.0 109.675 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.584 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.6 ttm180 -66.32 -52.09 50.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.905 -1.122 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 50.2 m -55.69 -54.09 48.53 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.133 -0.979 . . . . 0.0 110.228 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.555 ' OE1' ' CD2' ' A' ' 54' ' ' LEU . 1.0 OUTLIER -65.67 -43.68 88.57 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.975 -1.078 . . . . 0.0 112.012 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 110' ' ' GLU . 3.5 t80 -55.68 -41.72 74.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.06 -1.65 . . . . 0.0 108.893 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.7 mtp -53.14 -50.72 63.96 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.514 -0.741 . . . . 0.0 110.621 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 32.1 mttm -72.37 -53.95 10.82 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.031 -1.043 . . . . 0.0 112.875 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -85.51 -52.63 5.71 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 -174.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 9.1 mp -94.53 2.82 55.68 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.303 -1.498 . . . . 0.0 113.796 -175.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.635 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.1 t80 -62.98 -35.96 21.89 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 120.048 -1.657 . . . . 0.0 110.405 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.635 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 12.3 Cg_exo -68.53 -54.21 0.3 Allowed 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.13 1.887 . . . . 0.0 112.31 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.436 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 0.8 OUTLIER -56.97 -47.61 80.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.391 -0.818 . . . . 0.0 109.299 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 87.2 tt0 -68.89 -44.83 72.43 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.169 -0.957 . . . . 0.0 110.562 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.3 t -81.04 -45.97 15.74 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.977 -1.077 . . . . 0.0 111.244 -178.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 108' ' ' PRO . 44.1 tp10 -67.76 -51.7 45.9 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.634 -1.291 . . . . 0.0 111.518 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -73.72 -33.14 64.23 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.855 -1.153 . . . . 0.0 111.797 -178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -114.55 -29.48 6.82 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.833 -1.167 . . . . 0.0 111.784 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 111' ' ' CYS . 53.5 t30 57.29 44.79 21.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.6 -1.313 . . . . 0.0 110.288 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.08 -30.06 70.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.223 -0.923 . . . . 0.0 110.581 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.708 ' HG ' ' H ' ' A' ' 118' ' ' THR . 30.6 t -154.47 -167.25 2.56 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.917 -178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.708 ' H ' ' HG ' ' A' ' 117' ' ' SER . 82.1 p -129.01 159.49 68.47 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.515 -0.741 . . . . 0.0 109.672 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -55.52 -40.29 86.3 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.595 1.53 . . . . 0.0 112.207 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.29 -37.59 87.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.015 -1.053 . . . . 0.0 109.379 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.494 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.28 -46.06 74.75 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 17.6 tp -65.61 -53.28 43.85 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.404 -0.81 . . . . 0.0 109.942 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -56.86 -44.49 82.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.054 . . . . 0.0 108.907 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.05 85.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.114 -0.991 . . . . 0.0 109.155 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.416 ' CB ' HD22 ' A' ' 74' ' ' ASN . . . -68.28 -35.97 78.67 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 29.4 mt -64.09 -49.82 79.72 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.14 -38.46 86.48 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.88 88.67 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.656 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.05 -31.68 14.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.073 -1.251 . . . . 0.0 110.078 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.656 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.2 mtp180 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.853 -1.154 . . . . 0.0 109.607 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.3 mp0 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -48.51 -52.58 21.77 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.882 . . . . 0.0 109.81 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -61.22 -39.92 92.07 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.2 -0.938 . . . . 0.0 108.9 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.52 -49.18 67.38 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.365 -0.834 . . . . 0.0 110.798 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.418 ' O ' ' N ' ' A' ' 16' ' ' LEU . 2.7 m -70.96 -37.79 69.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 120.497 -1.377 . . . . 0.0 108.789 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -53.3 -39.21 63.83 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.592 -1.317 . . . . 0.0 107.761 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -58.93 -31.47 68.71 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' VAL . 8.3 mt -72.48 -38.75 68.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.281 -0.887 . . . . 0.0 111.504 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.496 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.5 m-85 -76.49 -33.24 58.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.433 -1.417 . . . . 0.0 110.314 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.479 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.5 mm-40 -66.98 -26.63 66.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.967 -1.083 . . . . 0.0 110.55 -178.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.479 ' C ' ' O ' ' A' ' 18' ' ' GLU . 32.2 mt -37.56 -38.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 O-C-N 121.798 -0.564 . . . . 0.0 110.487 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.72 161.62 7.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.858 -1.151 . . . . 0.0 110.323 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.7 p30 -88.99 66.52 7.88 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.539 0.685 . . . . 0.0 109.342 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -112.04 93.56 21.93 Favored Pre-proline 0 N--CA 1.489 1.503 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -47.1 -37.98 23.92 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.238 1.958 . . . . 0.0 112.004 -178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -62.77 -40.17 96.47 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.241 -0.912 . . . . 0.0 108.829 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.516 HH22 ' CG ' ' A' ' 55' ' ' ASP . 62.6 ttt180 -61.35 -37.08 82.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.478 -0.763 . . . . 0.0 110.454 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -60.16 -50.71 72.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.131 -0.981 . . . . 0.0 109.428 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -53.25 -38.77 63.32 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.431 -0.793 . . . . 0.0 109.677 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -62.01 -62.91 1.45 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.369 -0.832 . . . . 0.0 110.803 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 49.9 mt -55.57 -44.16 76.61 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.448 -0.782 . . . . 0.0 109.414 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.496 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 92.9 m-20 -60.99 -48.57 81.22 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.185 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.68 -42.73 86.04 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.132 -0.98 . . . . 0.0 109.546 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.48 -53.19 60.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.29 -0.881 . . . . 0.0 110.333 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -62.3 -33.25 74.31 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 118.483 -1.287 . . . . 0.0 107.811 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -67.92 -56.59 8.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.617 -0.677 . . . . 0.0 109.663 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.401 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 49.4 t80 -60.78 -42.28 97.22 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.253 -0.904 . . . . 0.0 110.3 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.483 ' CE ' ' O ' ' A' ' 41' ' ' THR . 73.7 mmm -59.17 -40.54 85.92 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.534 -0.729 . . . . 0.0 110.912 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -60.44 -41.57 94.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.954 -1.092 . . . . 0.0 109.72 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -61.9 -47.44 84.95 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.576 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.429 HH11 ' HB3' ' A' ' 108' ' ' PRO . 13.2 mtp180 -64.38 -20.93 66.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.105 -0.997 . . . . 0.0 111.282 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.35 3.01 58.82 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.723 -1.751 . . . . 0.0 108.723 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.483 ' O ' ' CE ' ' A' ' 36' ' ' MET . 34.3 p -117.6 83.67 17.82 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.46 -1.024 . . . . 0.0 108.874 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -91.57 139.84 2.39 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 123.054 2.503 . . . . 0.0 112.146 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 78.3 mt -73.46 99.0 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.02 -1.05 . . . . 0.0 109.026 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 94.2 m-20 -64.82 -45.48 86.02 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -133.99 132.58 40.29 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mt -70.97 142.66 88.02 Favored Pre-proline 0 C--N 1.299 -1.607 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.702 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -66.69 134.02 33.76 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.221 1.281 . . . . 0.0 109.095 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.15 145.71 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.884 -1.135 . . . . 0.0 110.068 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.408 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 80.7 mtp -141.56 118.84 11.42 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.408 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 69.43 43.13 1.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm 57.35 22.48 7.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.752 -0.593 . . . . 0.0 109.649 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.1 m -136.4 152.93 51.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 109.416 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.3 m -68.03 147.69 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 109.11 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.1 tp -79.45 123.17 27.28 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.412 -0.805 . . . . 0.0 110.369 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.516 ' CG ' HH22 ' A' ' 25' ' ' ARG . 12.1 m-20 -63.05 92.38 0.05 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.52 -0.738 . . . . 0.0 109.495 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.53 -27.57 57.83 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.989 -1.069 . . . . 0.0 109.718 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -78.21 -59.97 2.56 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.067 -1.021 . . . . 0.0 111.615 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -58.59 -36.33 73.83 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.743 -1.223 . . . . 0.0 109.871 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.93 -42.86 99.94 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.436 ' O ' ' C ' ' A' ' 61' ' ' ASN . 67.2 t80 -62.83 -68.08 0.37 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 60' ' ' TYR . 61.8 t30 -42.78 -34.67 0.97 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.469 -0.769 . . . . 0.0 109.35 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.519 ' CD2' HH22 ' A' ' 66' ' ' ARG . 13.6 mt -71.66 -50.89 26.33 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.443 HG22 ' CE2' ' A' ' 102' ' ' TYR . 37.6 t -56.6 -43.14 77.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.494 -0.754 . . . . 0.0 110.067 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.435 HG21 HD11 ' A' ' 64' ' ' ILE . 9.6 mm -69.68 -34.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.69 -1.256 . . . . 0.0 108.027 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.11 29.21 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.146 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.689 HH21 ' CB ' ' A' ' 80' ' ' GLU . 15.6 mmt-85 -95.13 -1.34 52.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.644 -1.285 . . . . 0.0 108.438 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.85 16.46 72.66 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.238 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.98 130.31 2.59 Favored Glycine 0 N--CA 1.502 3.049 0 CA-C-N 119.569 1.685 . . . . 0.0 111.618 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.1 tp -50.95 -41.83 59.34 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.631 -0.923 . . . . 0.0 110.465 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.0 t -57.86 -43.05 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.952 -1.092 . . . . 0.0 109.25 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -55.95 -37.5 69.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.111 -0.993 . . . . 0.0 108.656 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.1 t -66.73 -43.99 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.632 -0.667 . . . . 0.0 109.975 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.15 -57.58 9.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.759 -1.213 . . . . 0.0 110.124 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -58.02 -42.08 84.52 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.246 -0.909 . . . . 0.0 110.354 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.61 -9.02 39.44 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.279 -0.888 . . . . 0.0 110.692 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.626 ' N ' ' O ' ' A' ' 72' ' ' VAL . 25.1 mtmt 58.46 57.62 3.76 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.462 -0.773 . . . . 0.0 110.265 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.9 mt -91.37 12.63 19.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.951 -1.093 . . . . 0.0 108.594 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.487 ' O ' ' N ' ' A' ' 82' ' ' ILE . 87.6 m95 -61.11 -40.81 95.18 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt-30 -48.44 -40.93 27.9 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.898 -1.126 . . . . 0.0 108.749 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.689 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -66.61 -38.9 87.94 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.404 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.1 mt -72.9 -52.71 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.487 ' N ' ' O ' ' A' ' 78' ' ' TRP . 63.7 mt -54.15 -56.19 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.578 -0.701 . . . . 0.0 109.491 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 86' ' ' HIS . 44.9 mttp -66.68 -41.14 88.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.095 -1.003 . . . . 0.0 109.631 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.82 -30.67 29.58 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 mt -90.47 -8.78 49.59 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.428 -1.042 . . . . 0.0 109.099 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 83' ' ' LYS . 37.1 m-70 63.78 42.41 6.19 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.591 -0.693 . . . . 0.0 109.868 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.72 139.41 80.52 Favored Pre-proline 0 C--N 1.304 -1.405 0 O-C-N 121.242 -0.911 . . . . 0.0 108.583 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.611 ' C ' ' H ' ' A' ' 90' ' ' SER . 40.0 Cg_endo -69.93 142.95 48.56 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 121.915 1.743 . . . . 0.0 112.213 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.9 t -55.94 0.61 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.259 -0.901 . . . . 0.0 109.814 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.611 ' H ' ' C ' ' A' ' 88' ' ' PRO . 93.2 p -66.84 -26.0 66.7 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.222 -0.924 . . . . 0.0 110.193 -178.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.43 HG22 HD11 ' A' ' 91' ' ' ILE . 87.4 mt -101.47 107.41 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 120.92 -1.112 . . . . 0.0 109.522 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.9 p -79.05 -25.32 43.17 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.251 -0.905 . . . . 0.0 109.027 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -95.33 35.02 1.35 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.561 -0.712 . . . . 0.0 109.445 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.61 -65.2 0.73 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.138 -0.976 . . . . 0.0 108.631 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.17 -52.98 18.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.302 -0.874 . . . . 0.0 109.21 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.401 ' O ' ' OG1' ' A' ' 100' ' ' THR . 9.0 tp -58.95 -43.97 91.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.992 -1.067 . . . . 0.0 109.182 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 m -61.71 -39.96 93.36 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.953 -1.092 . . . . 0.0 108.692 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 12.0 mt -67.77 -44.22 77.96 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.562 -0.711 . . . . 0.0 110.068 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.778 ' NH1' HD22 ' A' ' 129' ' ' ASN . 28.6 ttm180 -68.81 -49.96 54.18 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.287 -0.883 . . . . 0.0 111.178 -179.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.525 ' H ' ' HG1' ' A' ' 100' ' ' THR . 0.6 OUTLIER -52.94 -53.18 53.27 Favored 'General case' 0 C--N 1.294 -1.837 0 C-N-CA 118.717 -1.193 . . . . 0.0 109.115 -178.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -63.83 -42.41 97.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.153 -0.967 . . . . 0.0 111.745 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.443 ' CE2' HG22 ' A' ' 63' ' ' VAL . 2.4 t80 -58.96 -43.91 91.38 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.207 -1.558 . . . . 0.0 109.395 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.426 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 89.7 mtp -51.52 -56.84 11.16 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.505 -0.747 . . . . 0.0 111.372 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -72.78 -52.67 14.06 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.767 -1.208 . . . . 0.0 112.701 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -85.14 -50.37 7.47 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -174.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.58 -5.02 40.13 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.126 -1.609 . . . . 0.0 114.109 -175.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.9 t80 -60.12 -38.56 60.51 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 119.687 -1.883 . . . . 0.0 109.62 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.7 Cg_exo -65.64 -54.79 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.421 2.081 . . . . 0.0 112.6 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.78 -39.55 81.4 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.367 -0.833 . . . . 0.0 109.137 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.401 ' OE1' ' N ' ' A' ' 111' ' ' CYS . 0.4 OUTLIER -73.12 -51.16 18.99 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.455 -0.778 . . . . 0.0 110.287 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -71.42 -43.02 67.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.403 -0.81 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.93 -51.09 59.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.863 -1.148 . . . . 0.0 111.033 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -74.71 -27.88 60.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.146 -0.971 . . . . 0.0 111.691 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -123.26 -30.31 3.72 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.911 -1.118 . . . . 0.0 111.298 -177.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 111' ' ' CYS . 40.0 t30 57.41 45.95 19.01 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.819 -1.176 . . . . 0.0 110.12 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.03 -31.72 72.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.174 -0.954 . . . . 0.0 110.894 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.2 t -154.39 -166.97 2.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.94 -1.1 . . . . 0.0 111.316 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.508 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.0 p -127.79 158.46 70.27 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.646 -0.659 . . . . 0.0 109.98 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -55.87 -41.32 78.43 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 121.651 1.567 . . . . 0.0 112.256 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.31 90.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.849 -1.157 . . . . 0.0 109.668 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.446 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.3 mt-10 -66.07 -42.4 89.47 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.9 tp -68.49 -52.71 29.31 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.71 -0.619 . . . . 0.0 110.173 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -58.26 -46.41 86.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.382 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.48 -42.23 98.47 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -0.854 . . . . 0.0 110.162 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.72 -33.62 75.24 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.533 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 11.1 mt -65.9 -46.49 88.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -64.73 -37.76 88.68 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.982 -1.074 . . . . 0.0 109.391 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.37 -29.86 75.61 Favored Glycine 0 N--CA 1.492 2.397 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.033 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.778 HD22 ' NH1' ' A' ' 99' ' ' ARG . 33.9 p-10 -92.0 -31.43 15.6 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.863 -1.374 . . . . 0.0 111.424 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.651 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 76.3 mtm180 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 120.516 -1.365 . . . . 0.0 110.237 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 36.0 mm-40 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.759 0.314 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -49.2 -46.67 45.96 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.724 -1.235 . . . . 0.0 109.252 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -61.18 -40.73 95.01 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.43 -0.794 . . . . 0.0 109.532 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.49 -53.17 25.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.323 -0.861 . . . . 0.0 111.404 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -36.14 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 120.803 -1.186 . . . . 0.0 109.279 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -58.74 -38.44 78.39 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.301 -1.499 . . . . 0.0 108.03 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -59.41 -31.71 69.51 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.218 -0.926 . . . . 0.0 108.655 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.09 -40.37 86.96 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.31 -0.869 . . . . 0.0 111.166 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 83.3 m-85 -74.9 -35.59 62.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.487 -1.383 . . . . 0.0 109.595 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.483 ' O ' ' C ' ' A' ' 19' ' ' ILE . 99.1 mt-10 -64.43 -29.9 70.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.627 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.483 ' C ' ' O ' ' A' ' 18' ' ' GLU . 24.2 mt -37.4 -41.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.607 -0.683 . . . . 0.0 110.702 -178.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -171.56 163.33 6.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.716 -1.24 . . . . 0.0 110.891 -178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -90.3 69.91 7.08 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.462 0.649 . . . . 0.0 109.596 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.01 94.93 27.24 Favored Pre-proline 0 N--CA 1.489 1.523 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -46.69 -44.44 21.7 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 122.166 1.911 . . . . 0.0 112.024 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -63.43 -40.37 96.97 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.179 -0.95 . . . . 0.0 108.615 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.433 -0.792 . . . . 0.0 109.803 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.0 -49.04 79.24 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.16 -0.963 . . . . 0.0 108.686 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -53.61 -38.25 63.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.463 -0.773 . . . . 0.0 109.385 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -64.03 -59.84 3.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.465 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.401 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 28.4 mt -56.45 -45.54 80.77 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.124 -0.985 . . . . 0.0 108.657 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.511 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 40.8 m-20 -60.15 -47.95 83.79 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.567 -0.853 . . . . 0.0 108.843 179.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -66.41 -43.49 85.6 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.484 -0.76 . . . . 0.0 109.889 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 tp -58.64 -49.75 76.37 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.211 -0.931 . . . . 0.0 110.306 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 49.4 m-85 -59.92 -36.93 78.07 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.953 -1.499 . . . . 0.0 107.792 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.422 ' O ' ' NZ ' ' A' ' 38' ' ' LYS . 36.4 m -69.71 -49.86 49.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.363 -0.836 . . . . 0.0 109.813 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 72.9 t80 -59.12 -46.21 88.92 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.302 -0.874 . . . . 0.0 111.123 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 95.4 mtp -57.36 -34.76 69.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.75 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -55.6 -34.99 65.35 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.647 -1.283 . . . . 0.0 108.784 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.422 ' NZ ' ' O ' ' A' ' 34' ' ' SER . 14.5 mmtm -74.75 -34.71 62.57 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.406 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 25.3 mmm180 -66.25 -30.97 71.51 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.028 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.23 0.17 63.5 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.0 p -115.25 85.18 12.39 Favored Pre-proline 0 N--CA 1.486 1.35 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.94 140.56 14.42 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 121.94 1.76 . . . . 0.0 110.513 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 29.8 mt -70.47 92.03 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 120.936 -1.103 . . . . 0.0 110.591 -177.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 21.7 m120 -58.9 -30.1 67.54 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -167.17 140.08 3.49 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.69 144.13 90.65 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.857 -1.152 . . . . 0.0 110.237 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.41 134.22 18.6 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.516 1.477 . . . . 0.0 108.369 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.439 HD13 HG23 ' A' ' 48' ' ' ILE . 56.6 mt -103.18 142.51 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 110.842 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.406 ' N ' HG21 ' A' ' 48' ' ' ILE . 82.2 mtp -136.24 123.95 22.44 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.04 39.97 4.2 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt 57.57 22.39 8.12 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.273 0.558 . . . . 0.0 110.119 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.3 m -134.38 151.16 51.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.257 -0.902 . . . . 0.0 109.22 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.56 143.46 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 120.774 -1.204 . . . . 0.0 108.708 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.3 tp -74.58 123.02 24.04 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.258 -0.901 . . . . 0.0 109.468 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -56.41 105.28 0.19 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.72 -30.57 71.58 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -80.21 -64.96 1.07 Allowed 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.238 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -52.95 -39.82 63.2 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 120.623 -1.298 . . . . 0.0 108.755 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.8 -48.7 74.92 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.403 ' CZ ' HD13 ' A' ' 64' ' ' ILE . 53.2 t80 -62.75 -66.8 0.49 Allowed 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.442 0.639 . . . . 0.0 109.913 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -43.06 -40.51 3.16 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.459 -0.776 . . . . 0.0 110.905 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.432 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -72.66 -47.07 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 117.897 -1.521 . . . . 0.0 107.836 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.421 HG21 ' CE2' ' A' ' 102' ' ' TYR . 26.6 t -55.34 -42.65 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.954 . . . . 0.0 109.987 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.441 HG22 HD12 ' A' ' 64' ' ' ILE . 13.0 mm -68.41 -35.67 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 120.504 -1.372 . . . . 0.0 107.715 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.85 -17.39 23.42 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.961 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.654 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.9 mmt-85 -96.99 5.3 50.7 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.524 -1.36 . . . . 0.0 108.986 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.6 11.24 82.14 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.646 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.99 134.56 3.29 Favored Glycine 0 N--CA 1.5 2.95 0 CA-C-N 119.252 1.526 . . . . 0.0 111.413 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 tp -48.55 -42.67 34.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.708 -0.877 . . . . 0.0 110.832 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.456 ' CG2' ' HG ' ' A' ' 117' ' ' SER . 95.1 t -58.11 -40.64 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.0 110.005 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -58.59 -40.36 82.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.002 . . . . 0.0 110.034 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.581 ' O ' ' N ' ' A' ' 76' ' ' LYS . 40.3 t -64.55 -47.01 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.264 -0.897 . . . . 0.0 110.639 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.08 -56.68 16.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.814 -1.179 . . . . 0.0 109.894 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.434 ' OD1' ' CB ' ' A' ' 125' ' ' ALA . 86.7 m-20 -59.56 -43.69 93.49 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.284 -0.885 . . . . 0.0 111.568 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -94.05 -4.46 49.41 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.909 -1.119 . . . . 0.0 110.685 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.581 ' N ' ' O ' ' A' ' 72' ' ' VAL . 51.0 mttm 59.24 56.74 3.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.595 -0.691 . . . . 0.0 111.135 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.6 mt -90.51 13.84 14.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.561 -1.256 . . . . 0.0 107.941 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' ILE . 96.9 m95 -63.49 -41.41 98.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.43 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.9 mt-30 -47.86 -39.92 19.98 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 120.809 -1.182 . . . . 0.0 108.011 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.654 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.3 mt-10 -67.33 -38.54 85.07 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.463 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.0 mt -74.78 -51.91 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.37 -0.831 . . . . 0.0 108.987 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' TRP . 60.8 mt -50.58 -51.47 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -74.65 -37.4 62.76 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.592 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.44 -32.92 46.18 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 83.2 mt -91.17 -7.31 51.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.38 -1.071 . . . . 0.0 109.255 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 65.03 40.59 5.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.777 -0.577 . . . . 0.0 110.106 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.3 mt -72.5 136.83 80.82 Favored Pre-proline 0 N--CA 1.488 1.467 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.561 ' C ' ' H ' ' A' ' 90' ' ' SER . 35.7 Cg_endo -68.54 144.23 60.06 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.891 1.727 . . . . 0.0 112.48 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.0 p -58.19 0.66 0.06 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.265 -0.897 . . . . 0.0 109.654 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.561 ' H ' ' C ' ' A' ' 88' ' ' PRO . 18.0 m -64.07 -35.31 80.32 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.138 -0.976 . . . . 0.0 109.301 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.401 HG23 HD12 ' A' ' 91' ' ' ILE . 89.5 mt -90.07 97.41 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.939 -1.101 . . . . 0.0 108.54 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 68.7 p -66.62 -27.86 68.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.873 . . . . 0.0 109.813 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.8 m -102.46 47.77 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.169 -0.957 . . . . 0.0 109.512 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.71 -59.43 3.58 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.169 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.83 -51.14 23.91 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.287 -0.883 . . . . 0.0 109.879 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.4 -44.29 88.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.748 -1.22 . . . . 0.0 109.039 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.3 m -60.81 -40.46 92.78 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.152 -0.968 . . . . 0.0 108.694 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.5 mt -71.18 -44.28 65.76 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.483 -0.761 . . . . 0.0 109.941 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.752 HH12 HD22 ' A' ' 129' ' ' ASN . 40.9 ttp180 -66.5 -53.1 38.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.24 -0.912 . . . . 0.0 110.947 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -56.59 -52.28 65.42 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.473 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -62.46 -40.08 95.46 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.046 -1.034 . . . . 0.0 110.978 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.421 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.7 t80 -57.08 -41.0 78.02 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.382 -1.449 . . . . 0.0 109.2 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.427 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.3 ttm -54.65 -54.72 37.89 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.463 -0.773 . . . . 0.0 111.396 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.8 mttt -72.65 -50.54 24.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.564 -1.335 . . . . 0.0 113.098 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.405 ' CD1' ' N ' ' A' ' 105' ' ' TYR . 34.3 m-85 -84.8 -52.86 5.74 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -174.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.0 mp -100.44 12.65 36.76 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.222 -1.549 . . . . 0.0 114.391 -175.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.525 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 62.7 t80 -67.37 -38.65 16.6 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 119.796 -1.815 . . . . 0.0 111.815 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.1 Cg_endo -78.05 -40.09 0.41 Allowed 'Trans proline' 0 N--CA 1.49 1.302 0 C-N-CA 121.475 1.45 . . . . 0.0 112.834 -178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.14 -42.97 87.04 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -68.96 -51.89 34.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.634 -0.666 . . . . 0.0 110.256 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.526 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.7 m -71.45 -43.69 66.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.376 -0.827 . . . . 0.0 110.932 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 46.4 tp10 -66.72 -50.26 63.38 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.086 -1.009 . . . . 0.0 111.223 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -75.83 -26.54 57.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.021 -1.049 . . . . 0.0 111.402 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.1 tptt -125.33 -30.46 3.14 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.043 -1.036 . . . . 0.0 111.82 -177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.3 OUTLIER 59.66 45.11 13.46 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.737 -1.227 . . . . 0.0 110.206 179.672 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 84.6 mt -69.57 -32.15 70.76 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.136 -0.978 . . . . 0.0 111.288 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 118' ' ' THR . 32.0 t -153.12 -167.04 2.6 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.515 -1.274 . . . . 0.0 112.064 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.531 ' N ' ' OG ' ' A' ' 117' ' ' SER . 40.1 p -129.81 155.26 80.75 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 121.835 -0.541 . . . . 0.0 109.695 -178.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.01 -40.63 80.4 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.112 1.875 . . . . 0.0 112.122 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.79 88.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.821 -1.174 . . . . 0.0 109.254 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.484 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.9 mt-10 -66.67 -45.25 79.53 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 34.6 tp -65.97 -51.77 55.5 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -57.26 -47.34 81.67 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.234 -0.916 . . . . 0.0 109.533 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.84 90.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.402 -0.811 . . . . 0.0 109.873 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.434 ' CB ' ' OD1' ' A' ' 74' ' ' ASN . . . -68.46 -36.09 78.51 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.055 0.931 . . . . 0.0 108.547 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.44 HD12 HG22 ' A' ' 126' ' ' ILE . 34.1 mt -65.59 -48.33 83.05 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.031 0 CA-C-O 121.521 0.677 . . . . 0.0 109.191 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -64.19 -37.22 86.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.406 -0.809 . . . . 0.0 109.095 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.6 -36.01 92.62 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.752 HD22 HH12 ' A' ' 99' ' ' ARG . 0.1 OUTLIER -93.87 -36.0 12.43 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.115 -1.226 . . . . 0.0 110.63 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.662 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 57.4 mtp180 . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.677 -1.264 . . . . 0.0 109.778 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -53.55 -48.52 69.03 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.308 -0.87 . . . . 0.0 109.471 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -62.45 -38.97 91.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.101 -0.999 . . . . 0.0 109.204 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.31 -48.74 72.04 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.77 . . . . 0.0 110.386 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -74.06 -34.67 39.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 O-C-N 120.761 -1.212 . . . . 0.0 108.218 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -54.65 -40.6 69.18 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -59.49 -31.08 69.03 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 11.7 mt -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.829 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.499 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -81.54 -32.24 32.36 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.536 -1.352 . . . . 0.0 110.458 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.486 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.6 mt-10 -67.73 -31.02 70.67 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.827 -1.171 . . . . 0.0 110.432 -178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.486 ' C ' ' O ' ' A' ' 18' ' ' GLU . 14.6 mt -35.28 -39.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.784 -0.572 . . . . 0.0 110.556 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.573 ' ND2' ' OD1' ' A' ' 22' ' ' ASP . 41.3 p-10 -173.72 167.06 4.5 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.97 -1.081 . . . . 0.0 110.034 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -94.22 64.75 3.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.624 -0.673 . . . . 0.0 109.821 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.573 ' OD1' ' ND2' ' A' ' 20' ' ' ASN . 1.7 m-20 -96.33 141.4 23.06 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.061 -1.024 . . . . 0.0 108.811 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.48 -61.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.14 1.893 . . . . 0.0 112.329 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -60.81 -34.09 74.01 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.858 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.667 ' CG ' HH11 ' A' ' 25' ' ' ARG . 0.8 OUTLIER -55.53 -44.95 77.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.98 -1.075 . . . . 0.0 109.954 -179.109 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -61.89 -54.71 38.28 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.04 -1.037 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.05 -37.91 61.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 108.872 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -61.37 -62.81 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.396 -0.815 . . . . 0.0 109.392 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.2 mt -54.17 -47.74 71.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.538 -0.726 . . . . 0.0 109.684 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 98.9 m-20 -61.31 -49.26 77.72 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.197 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -66.63 -42.3 86.99 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.998 -1.064 . . . . 0.0 109.635 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.67 -52.53 65.06 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.271 -0.893 . . . . 0.0 110.356 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -60.54 -34.34 73.99 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.984 -1.486 . . . . 0.0 107.74 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.3 m -69.29 -53.43 19.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.372 -0.83 . . . . 0.0 109.51 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 72.2 t80 -59.51 -40.13 86.07 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.568 -0.707 . . . . 0.0 110.57 -179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 75.3 mmm -58.96 -37.8 77.61 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.333 -0.854 . . . . 0.0 110.83 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.93 -39.41 94.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.909 -1.119 . . . . 0.0 110.286 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -69.47 -30.58 68.5 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.91 -1.119 . . . . 0.0 108.358 179.417 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.405 ' N ' ' HG3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -67.27 -30.58 70.49 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.76 -2.21 58.47 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 107.389 -2.284 . . . . 0.0 107.389 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 75.2 p -118.86 84.41 25.6 Favored Pre-proline 0 N--CA 1.491 1.597 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -83.02 137.15 8.4 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.561 2.174 . . . . 0.0 111.082 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.9 mt -73.98 97.73 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.038 -1.038 . . . . 0.0 109.94 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -65.41 -43.68 89.81 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.555 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.33 133.4 38.78 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mt -70.33 146.64 94.6 Favored Pre-proline 0 C--N 1.298 -1.65 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.528 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -67.08 127.29 16.54 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 121.209 1.273 . . . . 0.0 109.186 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.0 mt -96.11 143.67 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.848 -1.158 . . . . 0.0 109.763 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 57.3 mmm -140.54 123.35 16.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.669 0.747 . . . . 0.0 108.991 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.4 41.42 3.27 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.1 mttt 57.93 23.32 9.7 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.45 0.643 . . . . 0.0 109.89 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 89.7 p -136.98 155.62 49.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 108.936 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.28 148.42 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.972 -1.08 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.5 tp -81.66 122.91 28.22 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.685 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -65.17 89.43 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 0.0 109.07 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.5 mt -56.06 -23.54 34.13 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 120.786 -1.196 . . . . 0.0 109.168 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -78.43 -56.21 4.62 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.36 -0.838 . . . . 0.0 111.437 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.81 -39.33 91.35 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.815 -1.178 . . . . 0.0 110.132 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.7 -44.28 93.75 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.083 -1.011 . . . . 0.0 108.286 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.404 ' CZ ' HD12 ' A' ' 64' ' ' ILE . 52.9 t80 -56.21 -67.17 0.32 Allowed 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -43.17 -39.16 2.75 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 111.138 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.579 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 7.8 mt -70.66 -44.36 67.25 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 118.057 -1.457 . . . . 0.0 107.562 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG21 ' CE2' ' A' ' 102' ' ' TYR . 48.6 t -59.44 -45.05 93.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.264 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.404 HD12 ' CZ ' ' A' ' 60' ' ' TYR . 6.0 mm -68.22 -34.8 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.637 -1.289 . . . . 0.0 108.367 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.58 -26.95 35.52 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.774 -0.578 . . . . 0.0 110.358 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.614 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.9 mpt_? -90.74 -0.55 57.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.441 -1.412 . . . . 0.0 108.914 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.54 19.74 61.44 Favored Glycine 0 N--CA 1.489 2.221 0 C-N-CA 120.386 -0.912 . . . . 0.0 111.808 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 138.44 131.9 2.93 Favored Glycine 0 N--CA 1.499 2.838 0 O-C-N 120.672 -1.487 . . . . 0.0 111.418 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.65 -39.54 36.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.617 -0.931 . . . . 0.0 109.914 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 83.4 t -58.29 -43.22 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.212 -0.93 . . . . 0.0 109.907 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -54.99 -39.37 68.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.725 -1.234 . . . . 0.0 109.045 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.599 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.0 t -63.37 -42.11 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.49 -0.756 . . . . 0.0 109.845 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.439 HG12 HH11 ' A' ' 99' ' ' ARG . 72.7 mt -66.61 -58.52 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.661 -1.274 . . . . 0.0 110.454 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -56.64 -42.47 78.97 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.36 -9.46 38.73 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.22 -0.925 . . . . 0.0 110.826 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 72' ' ' VAL . 40.3 mttp 58.17 60.81 2.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.211 -0.93 . . . . 0.0 110.292 -178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.7 mt -93.23 16.24 13.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.017 -1.052 . . . . 0.0 108.497 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 82.3 m95 -64.78 -39.07 93.01 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.424 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.1 mm-40 -49.54 -38.28 30.28 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 118.425 -1.31 . . . . 0.0 108.093 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.614 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -69.26 -40.57 77.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 mt -71.75 -53.33 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.431 -0.793 . . . . 0.0 109.062 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.485 ' N ' ' O ' ' A' ' 78' ' ' TRP . 77.1 mt -51.48 -53.7 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 109.19 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -68.94 -39.15 79.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.223 -0.923 . . . . 0.0 110.201 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.7 -32.63 47.5 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.458 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 1.1 mm? -89.18 -7.95 54.61 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.385 -1.068 . . . . 0.0 108.7 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 63.96 42.34 5.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.837 -0.54 . . . . 0.0 110.331 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 142.16 83.62 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.201 -0.937 . . . . 0.0 108.934 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.601 ' C ' ' H ' ' A' ' 90' ' ' SER . 36.5 Cg_endo -69.86 143.2 49.59 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 C-N-CA 122.063 1.842 . . . . 0.0 112.456 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.7 p -55.61 -1.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.414 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 88' ' ' PRO . 23.3 m -64.43 -34.19 77.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 110.154 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 91' ' ' ILE . 80.0 mt -90.99 97.5 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 120.738 -1.226 . . . . 0.0 109.243 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 69.1 p -70.45 -21.92 62.75 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.284 -0.885 . . . . 0.0 109.194 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 57.9 m -104.25 43.37 1.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.467 -0.771 . . . . 0.0 109.159 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.39 -61.19 2.26 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.331 -0.856 . . . . 0.0 109.319 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.4 -50.47 30.8 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 109.807 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.7 tp -58.02 -46.06 85.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.765 -1.209 . . . . 0.0 109.116 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.2 m -58.92 -41.08 86.44 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.047 -1.033 . . . . 0.0 108.319 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.19 -44.46 68.66 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.802 . . . . 0.0 109.507 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.467 ' HG3' HH11 ' A' ' 99' ' ' ARG . 6.7 ttm-85 -65.81 -55.04 19.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.981 -1.074 . . . . 0.0 111.017 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.4 m -57.22 -52.9 63.46 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.436 -0.79 . . . . 0.0 111.003 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.66 -43.79 97.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.071 -1.018 . . . . 0.0 111.715 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.414 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.1 t80 -57.69 -39.65 77.66 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.356 -1.465 . . . . 0.0 109.595 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -54.46 -54.72 37.12 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.28 -0.888 . . . . 0.0 111.65 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -72.87 -52.88 13.03 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.477 -1.389 . . . . 0.0 113.198 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -84.68 -50.33 7.73 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 9.2 mp -97.2 6.23 48.78 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.235 -1.541 . . . . 0.0 113.863 -176.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.596 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 68.8 t80 -67.74 -37.01 10.85 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 119.955 -1.716 . . . . 0.0 111.684 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.558 ' O ' ' N ' ' A' ' 112' ' ' GLU . 60.6 Cg_endo -78.75 -40.98 0.26 Allowed 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 121.354 1.369 . . . . 0.0 112.096 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.54 -42.97 89.07 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -70.86 -46.04 63.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.599 -0.688 . . . . 0.0 110.072 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.1 t -77.03 -45.81 25.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.337 -0.852 . . . . 0.0 110.611 -178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.5 tp10 -66.22 -47.13 74.82 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.099 -1.001 . . . . 0.0 110.856 -178.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -76.61 -33.63 58.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.095 -1.003 . . . . 0.0 111.417 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -119.6 -27.43 5.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 111.783 -177.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 111' ' ' CYS . 24.1 t-20 55.76 45.34 24.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.78 -1.2 . . . . 0.0 110.389 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.1 mt -67.24 -31.34 71.63 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.176 -0.952 . . . . 0.0 110.966 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.521 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.5 t -154.65 -167.0 2.47 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 118.746 -1.182 . . . . 0.0 111.576 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.521 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.6 p -122.06 152.67 60.34 Favored Pre-proline 0 N--CA 1.497 1.907 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.596 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 10.9 Cg_endo -55.85 -38.76 94.09 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.883 1.722 . . . . 0.0 112.092 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.95 -37.71 88.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.98 -1.075 . . . . 0.0 109.539 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.467 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.7 mt-10 -66.96 -43.42 83.15 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.414 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 15.6 tp -64.31 -52.92 56.11 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.536 -0.728 . . . . 0.0 109.657 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -58.62 -47.25 84.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.331 -0.855 . . . . 0.0 109.794 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.12 -38.68 87.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 110.033 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.84 -34.04 76.92 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.543 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -68.42 -45.61 81.93 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 N-CA-C 108.102 -1.074 . . . . 0.0 108.102 177.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.437 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 62.5 t0 -58.94 -40.05 83.47 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.046 -1.034 . . . . 0.0 108.799 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.14 -26.83 73.73 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 17.5 p-10 -89.49 -31.82 17.49 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.766 -1.432 . . . . 0.0 110.595 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.652 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 85.5 mtm180 . . . . . 0 N--CA 1.492 1.636 0 O-C-N 120.662 -1.273 . . . . 0.0 110.083 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.608 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 36.2 mt-30 . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 120.631 0.253 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -54.24 -49.54 69.24 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.694 -1.254 . . . . 0.0 110.052 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.02 -42.32 99.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.068 -1.02 . . . . 0.0 109.453 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.04 -47.27 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.261 -0.899 . . . . 0.0 110.891 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 16' ' ' LEU . 2.7 m -72.67 -36.7 53.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 120.58 -1.325 . . . . 0.0 108.8 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -53.49 -40.44 65.36 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -59.45 -31.3 69.18 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 13' ' ' VAL . 10.9 mt -72.91 -36.33 67.24 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.462 -0.773 . . . . 0.0 111.633 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.485 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -79.05 -33.38 44.76 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.318 -1.489 . . . . 0.0 110.769 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.5 mm-40 -67.18 -26.35 66.6 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.888 -1.132 . . . . 0.0 110.528 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.474 ' C ' ' O ' ' A' ' 18' ' ' GLU . 28.7 mt -37.79 -39.55 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.617 -0.677 . . . . 0.0 110.694 -178.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -171.65 163.76 6.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.752 -1.218 . . . . 0.0 110.321 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -90.0 65.18 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.696 -0.627 . . . . 0.0 110.213 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -112.44 95.87 33.52 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.464 -0.773 . . . . 0.0 108.976 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.61 -40.16 30.2 Favored 'Trans proline' 0 N--CA 1.493 1.441 0 C-N-CA 122.358 2.038 . . . . 0.0 112.272 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -60.91 -41.1 95.46 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.02 -1.05 . . . . 0.0 108.592 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.651 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -59.79 -39.02 83.55 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.485 -0.76 . . . . 0.0 109.416 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.578 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 57.7 tttm -59.94 -50.58 73.2 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.16 -39.17 63.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.401 ' O ' ' N ' ' A' ' 32' ' ' LEU . 62.2 t80 -63.42 -61.86 2.06 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.486 -0.759 . . . . 0.0 109.539 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 74.7 mt -56.14 -46.73 79.13 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.345 -0.847 . . . . 0.0 109.067 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.578 ' OD2' ' NZ ' ' A' ' 26' ' ' LYS . 70.3 m-20 -62.29 -52.14 64.91 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.702 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.81 -40.87 92.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.244 -0.91 . . . . 0.0 109.188 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 28' ' ' PHE . 60.1 tp -57.23 -55.69 31.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.334 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.9 m-85 -60.63 -34.05 73.69 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.08 -1.448 . . . . 0.0 107.979 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -69.96 -52.95 20.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.514 -0.741 . . . . 0.0 110.614 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.415 ' CE1' ' NZ ' ' A' ' 113' ' ' LYS . 78.9 t80 -60.19 -43.57 95.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 111.908 -178.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 98.1 mtp -57.86 -34.36 69.67 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.095 -1.003 . . . . 0.0 111.123 -178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -54.12 -40.18 67.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.622 -1.299 . . . . 0.0 108.169 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -67.21 -37.53 83.78 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.469 -0.769 . . . . 0.0 109.358 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -63.5 -31.66 72.88 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.729 -0.607 . . . . 0.0 109.602 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.41 -2.96 61.2 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 108.238 -1.945 . . . . 0.0 108.238 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 39.6 p -118.99 85.18 28.41 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -83.49 144.6 11.48 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.58 2.187 . . . . 0.0 111.666 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.608 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 8.9 mt -77.13 94.07 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.109 -0.995 . . . . 0.0 109.264 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -61.0 -35.33 76.57 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.608 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -148.44 136.04 20.61 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 mt -71.45 145.49 90.43 Favored Pre-proline 0 C--N 1.297 -1.692 0 O-C-N 120.987 -1.071 . . . . 0.0 109.003 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -67.39 133.69 31.05 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 N-CA-C 108.982 -1.199 . . . . 0.0 108.982 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.7 mt -101.59 145.51 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.887 -1.133 . . . . 0.0 109.945 -178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.475 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 81.3 mtp -144.67 118.74 9.42 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 73.15 37.98 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mttt 57.79 25.15 11.59 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.639 0.733 . . . . 0.0 109.29 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 93.3 p -136.85 154.87 50.39 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.3 m -68.04 145.32 13.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.176 -0.953 . . . . 0.0 109.076 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 49.8 tp -77.92 123.61 27.0 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.306 -0.872 . . . . 0.0 109.512 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -62.89 88.51 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.8 mt -53.96 -25.43 20.65 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.87 -1.144 . . . . 0.0 108.957 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.502 ' HH ' HD22 ' A' ' 61' ' ' ASN . 43.9 t80 -78.86 -52.69 7.97 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.342 -0.849 . . . . 0.0 111.984 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -64.38 -37.34 87.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.556 -1.34 . . . . 0.0 110.165 -178.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.4 tp -58.79 -44.03 90.62 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.531 ' CE1' ' CD1' ' A' ' 64' ' ' ILE . 56.6 t80 -56.36 -73.66 0.06 Allowed 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.502 HD22 ' HH ' ' A' ' 57' ' ' TYR . 89.8 m-20 -39.36 -41.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.257 -0.902 . . . . 0.0 111.782 -177.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mt -71.46 -44.48 64.71 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 117.943 -1.503 . . . . 0.0 107.945 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.408 HG11 ' CZ ' ' A' ' 102' ' ' TYR . 19.1 t -59.34 -46.69 92.3 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.164 179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.531 ' CD1' ' CE1' ' A' ' 60' ' ' TYR . 5.5 mm -68.99 -35.59 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.769 -1.207 . . . . 0.0 107.843 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.57 -23.0 9.5 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.628 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.497 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.4 mpt_? -92.26 -1.94 56.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.648 -1.283 . . . . 0.0 108.782 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.48 19.47 64.07 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.166 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.07 127.54 2.23 Favored Glycine 0 N--CA 1.5 2.929 0 CA-C-N 119.596 1.698 . . . . 0.0 111.846 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -46.91 -39.39 12.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.586 -0.95 . . . . 0.0 109.526 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.6 t -59.43 -42.1 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.223 -0.923 . . . . 0.0 109.656 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -55.01 -42.7 72.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.036 -1.04 . . . . 0.0 109.47 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 76' ' ' LYS . 22.5 t -63.28 -43.42 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.468 -0.77 . . . . 0.0 110.201 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -64.95 -56.72 14.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 O-C-N 120.813 -1.179 . . . . 0.0 110.45 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -57.38 -41.94 81.18 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -93.6 -9.91 36.45 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.029 -1.044 . . . . 0.0 110.436 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 72' ' ' VAL . 38.6 mtmt 58.73 59.96 2.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.441 -0.787 . . . . 0.0 109.772 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.3 mt -93.01 14.38 17.89 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.189 -0.945 . . . . 0.0 108.663 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.8 m95 -62.27 -39.38 92.73 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 78' ' ' TRP . 87.6 mm-40 -49.08 -39.29 27.38 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.722 -1.236 . . . . 0.0 108.386 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.497 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.1 mm-40 -69.83 -39.54 76.4 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt -71.08 -54.87 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.295 -0.878 . . . . 0.0 108.881 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.485 ' N ' ' O ' ' A' ' 78' ' ' TRP . 75.1 mt -51.24 -55.61 7.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -68.41 -36.8 79.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.063 -1.023 . . . . 0.0 109.206 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.45 -34.99 49.95 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.6 mt -88.27 -7.25 57.06 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.351 -1.088 . . . . 0.0 108.667 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 66.54 40.58 3.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.236 0.541 . . . . 0.0 110.004 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.43 142.87 81.92 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.939 . . . . 0.0 108.545 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.573 ' C ' ' H ' ' A' ' 90' ' ' SER . 42.3 Cg_endo -70.34 144.28 50.46 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.142 1.895 . . . . 0.0 112.301 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 p -57.57 -0.35 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.205 -0.935 . . . . 0.0 109.486 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.573 ' H ' ' C ' ' A' ' 88' ' ' PRO . 13.8 m -65.01 -30.74 71.74 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.354 -0.841 . . . . 0.0 109.844 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.42 HG22 HD13 ' A' ' 91' ' ' ILE . 70.8 mt -93.81 97.54 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 120.656 -1.278 . . . . 0.0 109.274 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.6 p -71.87 -25.0 61.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.938 . . . . 0.0 109.345 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 m -101.88 41.77 1.19 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.64 -59.58 3.02 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.349 -0.845 . . . . 0.0 109.252 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.22 -52.6 15.44 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.152 -0.967 . . . . 0.0 109.038 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.485 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.0 tp -58.63 -44.63 90.07 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.06 -1.025 . . . . 0.0 109.214 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.3 m -60.2 -40.27 89.47 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.116 -0.99 . . . . 0.0 108.903 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.77 -46.08 69.69 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.614 -0.679 . . . . 0.0 109.786 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.52 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 37.4 ttm180 -64.94 -51.42 61.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.333 -0.854 . . . . 0.0 110.884 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -54.69 -54.75 37.69 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.671 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -62.59 -42.0 99.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 0.0 111.559 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.408 ' CZ ' HG11 ' A' ' 63' ' ' VAL . 3.2 t80 -58.02 -43.33 86.64 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 120.207 -1.558 . . . . 0.0 109.256 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.414 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 85.3 mtp -53.36 -57.43 10.62 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.734 -0.604 . . . . 0.0 112.325 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -72.82 -51.26 19.6 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.671 -1.268 . . . . 0.0 112.79 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -84.27 -47.41 10.8 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.86 -1.43 40.18 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.33 -1.481 . . . . 0.0 114.035 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.643 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 81.1 t80 -63.12 -36.86 27.19 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 119.746 -1.846 . . . . 0.0 110.337 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.643 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.2 Cg_exo -67.07 -56.39 0.24 Allowed 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.145 1.896 . . . . 0.0 111.855 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.76 -43.44 85.45 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -72.95 -49.9 26.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.301 -0.874 . . . . 0.0 110.641 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.514 ' HG ' ' HH ' ' A' ' 107' ' ' TYR . 7.4 t -76.8 -43.05 38.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.156 -0.965 . . . . 0.0 111.199 -178.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.5 tp10 -68.8 -50.35 50.93 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.577 -1.327 . . . . 0.0 110.996 -178.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.415 ' NZ ' ' CE1' ' A' ' 35' ' ' PHE . 42.4 mmtt -74.0 -35.76 64.44 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.115 -0.991 . . . . 0.0 111.699 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -111.02 -29.04 8.06 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.838 -1.163 . . . . 0.0 111.612 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 54.61 44.67 28.3 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.643 -1.286 . . . . 0.0 110.607 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.07 -30.88 71.48 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.117 -0.989 . . . . 0.0 110.398 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.431 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 23.1 t -154.24 -166.7 2.43 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.406 -178.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 74.2 p -127.53 159.81 63.82 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.595 -0.691 . . . . 0.0 109.753 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.45 -39.28 90.24 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.613 1.542 . . . . 0.0 112.256 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.59 -37.95 89.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.969 -1.082 . . . . 0.0 109.775 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.431 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 56.0 mt-10 -66.4 -44.73 82.2 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -66.66 -51.72 53.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.349 0.595 . . . . 0.0 110.08 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -57.74 -47.02 83.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.0 109.863 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.13 91.91 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.238 -0.914 . . . . 0.0 109.877 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.96 -34.33 75.15 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.939 0.876 . . . . 0.0 108.7 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.414 ' CD1' ' SD ' ' A' ' 103' ' ' MET . 13.2 mt -63.59 -52.24 60.12 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -61.74 -36.85 82.17 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.458 -0.897 . . . . 0.0 109.04 179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.84 -31.64 81.08 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.666 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.92 -35.62 14.62 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.055 -1.262 . . . . 0.0 111.183 -178.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.666 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.7 mtm180 . . . . . 0 N--CA 1.492 1.667 0 O-C-N 120.714 -1.241 . . . . 0.0 110.203 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.521 ' N ' ' CD ' ' A' ' 9' ' ' GLN . 1.8 mp0 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.17 -50.82 70.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.405 -0.809 . . . . 0.0 109.322 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.66 -41.66 99.18 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.055 -1.028 . . . . 0.0 109.213 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.58 -48.16 75.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.337 -0.852 . . . . 0.0 110.586 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.68 -37.15 73.34 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 120.674 -1.266 . . . . 0.0 107.796 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -54.52 -41.52 69.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -58.95 -29.91 67.49 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.304 -0.958 . . . . 0.0 108.762 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.42 -38.45 68.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 111.333 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.524 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.0 m-85 -76.67 -33.53 58.27 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.509 -1.369 . . . . 0.0 110.457 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.3 mt-10 -65.72 -26.92 67.97 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.844 -1.16 . . . . 0.0 110.325 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 18' ' ' GLU . 32.9 mt -38.39 -40.28 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 O-C-N 121.604 -0.685 . . . . 0.0 110.665 -179.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -170.74 164.45 8.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.744 -1.223 . . . . 0.0 110.758 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -89.84 68.38 7.41 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.396 0.617 . . . . 0.0 109.774 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -112.44 94.28 26.57 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.13 -41.72 40.61 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.01 1.807 . . . . 0.0 111.974 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -63.38 -41.72 98.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.107 -0.996 . . . . 0.0 108.611 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.582 HH22 ' CG ' ' A' ' 55' ' ' ASP . 66.3 ttt180 -58.68 -37.78 76.79 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.432 -0.793 . . . . 0.0 109.297 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.74 -49.35 78.06 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.359 -0.838 . . . . 0.0 108.845 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.62 -37.75 65.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.554 -0.716 . . . . 0.0 109.365 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.48 -61.22 2.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.269 -0.894 . . . . 0.0 110.695 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.45 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 54.7 mt -54.7 -47.56 73.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.284 -0.885 . . . . 0.0 109.295 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.524 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 88.1 m-20 -62.13 -46.17 90.19 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.821 -0.752 . . . . 0.0 109.395 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -67.1 -44.42 80.04 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.189 -0.944 . . . . 0.0 109.389 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.8 tp -55.56 -51.26 67.68 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.429 -0.795 . . . . 0.0 109.924 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.9 m-85 -61.0 -34.83 75.42 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 118.442 -1.303 . . . . 0.0 107.85 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -70.78 -52.84 18.08 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.559 -0.713 . . . . 0.0 110.524 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.68 -45.04 90.29 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.271 -0.893 . . . . 0.0 111.124 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.6 mtp -58.38 -33.57 69.75 Favored 'General case' 0 C--N 1.296 -1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.22 -179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -52.78 -39.12 61.99 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.96 -1.087 . . . . 0.0 108.652 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -71.03 -37.35 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -65.21 -30.45 71.35 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.76 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.73 0.74 64.11 Favored Glycine 0 N--CA 1.485 1.965 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.5 p -117.21 84.81 17.86 Favored Pre-proline 0 N--CA 1.491 1.58 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -83.77 141.14 9.53 Favored 'Trans proline' 0 C--N 1.301 -1.945 0 C-N-CA 122.507 2.138 . . . . 0.0 111.4 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.4 mt -76.36 97.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.997 -1.064 . . . . 0.0 109.725 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.487 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 24.5 t-20 -68.15 -45.94 72.18 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -130.03 132.16 46.12 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.7 mt -70.17 128.3 91.61 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 120.889 -1.132 . . . . 0.0 109.879 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -53.32 126.35 21.37 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 N-CA-C 108.777 -1.278 . . . . 0.0 108.777 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.2 mt -99.34 142.28 15.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.946 -1.096 . . . . 0.0 110.187 -178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 79.6 mtp -137.99 124.43 20.7 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.77 40.42 3.21 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 57.27 22.84 8.11 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.332 0.587 . . . . 0.0 110.286 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.1 p -136.08 153.42 51.33 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.187 -0.946 . . . . 0.0 109.079 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -66.74 145.62 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.984 -1.072 . . . . 0.0 108.941 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 49.6 tp -80.14 124.44 28.78 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.271 -0.893 . . . . 0.0 110.023 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.582 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.0 m-20 -63.73 88.59 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -52.42 -24.86 8.55 Favored 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.883 -1.136 . . . . 0.0 109.235 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -80.3 -57.86 3.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.237 -0.914 . . . . 0.0 111.938 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -56.81 -38.24 72.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.525 -1.359 . . . . 0.0 109.34 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.0 tp -58.75 -52.4 65.86 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -51.91 -66.36 0.4 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.374 0.607 . . . . 0.0 109.832 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -42.83 -43.11 3.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.508 -0.745 . . . . 0.0 111.636 -178.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.49 -40.75 70.02 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.136 -1.426 . . . . 0.0 107.402 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.426 HG23 ' CE2' ' A' ' 102' ' ' TYR . 44.1 t -60.99 -45.5 98.41 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 C-N-CA 119.611 -0.836 . . . . 0.0 109.516 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.45 HG21 HD13 ' A' ' 64' ' ' ILE . 13.9 mm -68.75 -45.97 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.747 -1.22 . . . . 0.0 107.886 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -4.66 2.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.807 -0.558 . . . . 0.0 109.683 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.569 ' NH2' ' OE1' ' A' ' 80' ' ' GLU . 0.1 OUTLIER -101.89 9.39 40.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.103 -0.998 . . . . 0.0 108.841 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.51 7.85 87.72 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.348 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 122.8 142.63 6.21 Favored Glycine 0 N--CA 1.501 2.989 0 O-C-N 121.015 -1.285 . . . . 0.0 110.999 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -52.18 -41.41 62.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.714 -0.874 . . . . 0.0 110.77 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.2 t -57.25 -41.76 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.747 -1.221 . . . . 0.0 108.916 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -59.07 -38.79 80.28 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.936 -1.102 . . . . 0.0 109.381 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.2 t -61.8 -46.86 95.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.329 -0.857 . . . . 0.0 110.208 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.9 mt -63.9 -61.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.072 -1.018 . . . . 0.0 109.979 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -58.89 -41.33 86.9 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.577 -0.702 . . . . 0.0 110.831 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -93.2 -7.36 45.45 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.978 -1.076 . . . . 0.0 110.985 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 72' ' ' VAL . 22.6 mtmt 57.4 56.99 4.66 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.125 -0.985 . . . . 0.0 110.492 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 18.2 mt -89.53 13.11 14.71 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.4 m95 -62.42 -42.86 99.76 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.635 -0.666 . . . . 0.0 109.362 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.3 mm-40 -49.69 -38.32 32.53 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.806 -1.184 . . . . 0.0 108.33 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.569 ' OE1' ' NH2' ' A' ' 66' ' ' ARG . 98.6 mt-10 -68.92 -40.48 79.03 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -72.47 -54.28 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.473 -0.767 . . . . 0.0 109.172 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.465 ' N ' ' O ' ' A' ' 78' ' ' TRP . 73.1 mt -53.15 -52.87 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 121.26 -0.9 . . . . 0.0 109.219 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -69.27 -40.28 77.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 109.344 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.73 -33.73 42.81 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.8 mt -87.66 -8.32 56.31 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.376 -1.073 . . . . 0.0 108.851 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 65.26 39.89 5.15 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.4 mt -73.03 139.71 79.91 Favored Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.338 -0.851 . . . . 0.0 108.752 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.51 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.6 Cg_endo -67.26 142.57 61.06 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.946 1.764 . . . . 0.0 111.892 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -61.37 1.16 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.268 -0.895 . . . . 0.0 109.826 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.51 ' H ' ' C ' ' A' ' 88' ' ' PRO . 60.4 p -65.65 -24.31 67.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.263 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.435 HD11 HG23 ' A' ' 91' ' ' ILE . 90.9 mt -98.13 106.31 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.957 -1.089 . . . . 0.0 109.001 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -78.5 -22.57 47.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.107 -0.995 . . . . 0.0 108.657 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 27.8 m -95.49 34.29 1.48 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.402 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -62.01 -65.9 0.62 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.067 -1.021 . . . . 0.0 108.854 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.85 27.97 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.304 -0.873 . . . . 0.0 109.52 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.488 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.4 tp -58.53 -44.29 89.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.861 -1.149 . . . . 0.0 109.044 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 m -61.79 -40.96 97.03 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 120.942 -1.099 . . . . 0.0 109.441 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.4 mt -68.38 -45.83 71.66 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.399 -0.813 . . . . 0.0 110.298 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.623 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 34.9 ttp180 -64.45 -49.85 69.85 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.136 -0.978 . . . . 0.0 110.622 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -56.16 -54.82 40.59 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.112 -0.992 . . . . 0.0 109.804 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -62.58 -42.59 99.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.063 -1.023 . . . . 0.0 111.024 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.426 ' CE2' HG23 ' A' ' 63' ' ' VAL . 5.2 t80 -56.97 -43.17 81.36 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 120.441 -1.412 . . . . 0.0 109.44 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 42.5 mtt -54.32 -53.9 47.59 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.491 -0.755 . . . . 0.0 111.185 -179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.1 mttm -72.25 -57.14 4.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.895 -1.128 . . . . 0.0 112.47 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -83.02 -15.09 52.49 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -175.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 mt -137.17 17.87 2.98 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 120.082 -1.636 . . . . 0.0 112.893 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.631 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 37.6 t80 -72.08 -35.01 3.17 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 120.153 -1.592 . . . . 0.0 110.617 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.9 Cg_endo -83.79 -39.06 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.757 1.638 . . . . 0.0 112.799 -179.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.61 -41.55 86.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.625 -1.297 . . . . 0.0 107.857 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -71.86 -50.79 26.39 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.538 -0.726 . . . . 0.0 110.067 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.578 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -74.92 -44.0 51.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.496 -0.753 . . . . 0.0 111.083 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 38.8 tp10 -66.08 -47.36 74.53 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.901 -1.124 . . . . 0.0 110.605 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -74.87 -33.94 62.16 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.162 -0.961 . . . . 0.0 111.163 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -120.52 -27.98 5.04 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.186 -0.946 . . . . 0.0 111.848 -177.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.578 ' N ' ' O ' ' A' ' 111' ' ' CYS . 35.5 t-20 57.25 44.91 21.25 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.564 -1.335 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 68.5 mt -67.52 -30.39 70.03 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.201 -0.937 . . . . 0.0 111.249 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.685 ' HG ' ' H ' ' A' ' 118' ' ' THR . 8.8 t -153.13 -169.1 3.22 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 118.553 -1.259 . . . . 0.0 111.743 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.685 ' H ' ' HG ' ' A' ' 117' ' ' SER . 70.1 p -126.47 163.23 41.85 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.754 -0.592 . . . . 0.0 109.643 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.6 -37.95 85.08 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 121.571 1.514 . . . . 0.0 111.971 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.54 -36.72 83.51 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.995 . . . . 0.0 109.037 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.479 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.5 mt-10 -66.87 -48.78 67.71 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 56.5 tp -57.54 -58.01 10.18 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.525 -0.735 . . . . 0.0 109.974 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -56.8 -45.71 82.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.496 -0.753 . . . . 0.0 109.394 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.13 -36.5 77.65 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.802 -1.186 . . . . 0.0 108.466 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.18 -35.91 74.29 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.3 mt -60.14 -52.5 60.58 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -64.31 -38.03 89.58 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.01 -30.25 69.71 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.85 -32.88 13.05 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.846 -1.385 . . . . 0.0 110.94 -178.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 O-C-N 120.773 -1.204 . . . . 0.0 109.362 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.54 ' NE2' ' C ' ' A' ' 44' ' ' ASN . 42.2 mm-40 . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.65 ' CZ ' ' NE ' ' A' ' 14' ' ' ARG . 52.4 t80 -54.91 -50.18 69.44 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.29 -0.881 . . . . 0.0 108.95 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -62.86 -40.78 98.55 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.025 -1.047 . . . . 0.0 109.59 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.65 -47.98 73.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.832 . . . . 0.0 111.006 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.11 -38.06 73.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 120.702 -1.249 . . . . 0.0 108.992 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.65 ' NE ' ' CZ ' ' A' ' 10' ' ' PHE . 7.7 mmt-85 -55.91 -39.82 72.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.392 -1.443 . . . . 0.0 108.347 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -58.71 -29.0 66.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mt -75.32 -39.51 59.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.404 -0.81 . . . . 0.0 111.634 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.4 m-85 -74.86 -34.16 62.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.5 -1.375 . . . . 0.0 110.578 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 19' ' ' ILE . 77.8 mm-40 -64.77 -26.99 68.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.923 -1.111 . . . . 0.0 110.154 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.49 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 41.8 mt -39.87 -40.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.72 -0.612 . . . . 0.0 110.652 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.49 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.4 m120 -171.13 160.95 6.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.716 -1.24 . . . . 0.0 110.448 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 52.3 p30 -91.65 64.42 4.9 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.49 0.662 . . . . 0.0 109.724 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.0 107.66 60.83 Favored Pre-proline 0 N--CA 1.489 1.502 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -46.87 -51.78 8.68 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.031 1.821 . . . . 0.0 112.513 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.16 -36.1 78.89 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.169 -0.957 . . . . 0.0 109.337 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.636 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -59.41 -44.97 92.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -62.32 -53.27 57.51 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.308 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -51.69 -37.67 51.75 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.525 -0.735 . . . . 0.0 109.208 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -62.01 -62.58 1.69 Allowed 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.468 -0.77 . . . . 0.0 110.318 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 57.5 mt -54.77 -45.45 74.24 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.487 -0.758 . . . . 0.0 109.148 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -61.73 -47.64 84.3 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.035 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -66.68 -44.82 80.75 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.415 -0.803 . . . . 0.0 109.762 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.43 -51.74 67.25 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.349 -0.844 . . . . 0.0 110.898 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -62.53 -33.06 74.15 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 118.104 -1.438 . . . . 0.0 108.207 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 m -68.99 -55.03 12.13 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.408 -0.807 . . . . 0.0 110.203 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.405 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 46.3 t80 -61.91 -38.45 88.43 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.894 . . . . 0.0 111.656 -178.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.5 mmm -58.22 -34.79 70.8 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.857 -1.152 . . . . 0.0 110.748 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -56.27 -37.63 70.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.772 -1.205 . . . . 0.0 109.25 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.1 -28.47 57.53 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.405 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 13.6 mmm180 -66.7 -32.05 73.1 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.733 -0.787 . . . . 0.0 109.428 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.55 -2.21 62.49 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.725 -2.15 . . . . 0.0 107.725 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.8 p -118.72 84.9 26.18 Favored Pre-proline 0 N--CA 1.49 1.545 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.17 12.34 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.527 2.151 . . . . 0.0 111.207 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.82 99.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.048 -1.032 . . . . 0.0 110.042 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.54 ' C ' ' NE2' ' A' ' 9' ' ' GLN . 27.5 m120 -79.11 -3.96 47.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.25 -0.906 . . . . 0.0 108.648 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -176.45 123.2 0.16 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.279 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.29 144.06 91.66 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 120.953 -1.092 . . . . 0.0 108.93 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -67.08 138.85 48.89 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 121.501 1.467 . . . . 0.0 109.558 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.454 HG21 HD12 ' A' ' 48' ' ' ILE . 35.3 mt -105.55 142.69 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.02 -1.05 . . . . 0.0 110.269 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 80.3 mtp -134.52 125.71 27.89 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.49 40.03 8.59 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.5 mttt 58.94 25.02 13.22 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.857 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 84.8 p -137.56 154.58 49.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.369 -0.832 . . . . 0.0 109.524 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.26 144.3 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.197 -0.939 . . . . 0.0 109.975 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.0 tp -77.16 122.63 25.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.544 -0.722 . . . . 0.0 109.396 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -61.86 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.656 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.28 -26.87 42.86 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 120.92 -1.112 . . . . 0.0 109.149 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -78.1 -63.46 1.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.136 -0.978 . . . . 0.0 111.564 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -57.1 -38.73 73.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.684 -1.26 . . . . 0.0 110.267 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 tp -58.72 -43.47 90.14 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.546 -1.346 . . . . 0.0 107.853 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.415 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.2 t80 -60.03 -67.5 0.38 Allowed 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.412 0.625 . . . . 0.0 109.547 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -41.94 -41.4 2.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.515 -0.74 . . . . 0.0 111.429 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.1 -44.07 69.74 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.12 -1.432 . . . . 0.0 107.743 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.402 HG22 ' CE2' ' A' ' 102' ' ' TYR . 23.5 t -58.14 -45.22 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.393 -0.817 . . . . 0.0 110.403 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.415 HG13 ' CE2' ' A' ' 60' ' ' TYR . 5.1 mm -71.01 -33.43 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 120.735 -1.228 . . . . 0.0 108.313 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.41 ' HB1' HH11 ' A' ' 66' ' ' ARG . . . -54.47 -24.38 20.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.646 -178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.471 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -92.46 -2.55 56.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.809 -1.182 . . . . 0.0 108.799 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.1 16.74 66.55 Favored Glycine 0 N--CA 1.491 2.312 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.434 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 145.28 128.11 2.0 Allowed Glycine 0 N--CA 1.498 2.801 0 CA-C-N 119.675 1.737 . . . . 0.0 111.85 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tp -46.92 -38.33 10.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.63 -0.924 . . . . 0.0 109.695 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.61 -41.19 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.455 -179.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -58.61 -42.99 89.46 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.878 -1.139 . . . . 0.0 109.695 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 76' ' ' LYS . 61.9 t -59.68 -43.43 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 109.349 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -66.84 -56.89 12.13 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 120.851 -1.156 . . . . 0.0 109.623 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -57.79 -41.77 82.8 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.161 -0.962 . . . . 0.0 110.312 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -92.27 -9.58 41.55 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.178 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.616 ' N ' ' O ' ' A' ' 72' ' ' VAL . 28.3 mtmt 58.03 57.7 3.94 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -0.868 . . . . 0.0 109.67 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.6 mt -92.98 16.6 12.33 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.949 -1.094 . . . . 0.0 108.52 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.45 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.1 m95 -64.26 -39.75 94.59 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.439 ' C ' ' O ' ' A' ' 78' ' ' TRP . 16.3 mm100 -48.81 -38.88 23.38 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.287 -1.365 . . . . 0.0 108.026 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.471 ' CB ' HH21 ' A' ' 66' ' ' ARG . 78.8 mm-40 -69.64 -40.92 76.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.83 -54.47 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.45 ' N ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt -50.33 -54.2 9.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -68.4 -38.49 81.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.77 -34.0 50.16 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.1 mt -88.13 -8.33 55.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.35 -1.088 . . . . 0.0 108.823 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 66.25 39.5 4.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.781 -0.575 . . . . 0.0 109.934 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.0 mt -73.79 146.74 85.86 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.584 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.7 Cg_endo -74.04 139.96 27.69 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 C-N-CA 122.081 1.854 . . . . 0.0 112.149 179.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.1 p -56.38 -0.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.822 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.584 ' H ' ' C ' ' A' ' 88' ' ' PRO . 86.8 p -67.31 -24.2 65.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.157 -0.964 . . . . 0.0 110.12 -178.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 94' ' ' ALA . 81.5 mt -96.99 102.01 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 120.751 -1.218 . . . . 0.0 109.274 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 52.3 p -73.43 -28.04 61.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 108.899 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.442 ' O ' ' OG1' ' A' ' 97' ' ' THR . 69.4 m -92.04 30.51 1.41 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -61.83 -65.55 0.67 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.287 -0.883 . . . . 0.0 108.684 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.37 -51.27 35.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 109.178 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.04 -42.71 90.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.976 -1.077 . . . . 0.0 108.756 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 93' ' ' SER . 52.2 m -60.99 -40.84 95.03 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.246 -0.909 . . . . 0.0 108.707 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.29 -48.18 62.4 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.608 -0.682 . . . . 0.0 109.929 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -65.89 -49.03 69.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.144 -0.973 . . . . 0.0 110.919 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -55.83 -54.73 40.95 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 109.846 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.7 -40.9 98.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.274 -0.891 . . . . 0.0 111.115 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.402 ' CE2' HG22 ' A' ' 63' ' ' VAL . 3.6 t80 -57.78 -41.05 81.24 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.454 -1.404 . . . . 0.0 109.571 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.493 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.1 ttm -53.65 -54.1 42.6 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.426 -0.796 . . . . 0.0 111.552 -178.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -72.0 -54.5 9.72 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.661 -1.275 . . . . 0.0 113.164 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -85.41 -44.59 12.63 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 mt -97.96 -7.69 29.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.315 -1.49 . . . . 0.0 114.231 -175.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.8 t80 -59.87 -38.18 57.48 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 119.84 -1.788 . . . . 0.0 109.209 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 15.8 Cg_exo -67.71 -52.07 0.6 Allowed 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.333 2.022 . . . . 0.0 112.036 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -60.67 -38.45 84.98 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -73.33 -52.2 14.72 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.619 -0.676 . . . . 0.0 109.95 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 73.0 m -71.24 -43.87 66.42 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.475 -0.766 . . . . 0.0 110.888 -178.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -67.77 -47.12 70.07 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.018 -1.051 . . . . 0.0 111.407 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt -74.78 -33.59 62.29 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.99 -1.069 . . . . 0.0 112.145 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.47 -25.13 3.78 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.853 -1.154 . . . . 0.0 111.641 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 60.64 48.76 7.0 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.687 -1.258 . . . . 0.0 110.285 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.1 -33.85 76.35 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.106 -0.996 . . . . 0.0 111.264 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.556 ' OG ' ' N ' ' A' ' 118' ' ' THR . 26.6 t -155.43 -166.62 2.3 Favored 'General case' 0 N--CA 1.496 1.828 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.315 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.556 ' N ' ' OG ' ' A' ' 117' ' ' SER . 69.7 p -130.6 156.76 79.26 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.562 -0.711 . . . . 0.0 110.078 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -51.72 -42.82 54.92 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 121.906 1.737 . . . . 0.0 112.493 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.98 -38.96 93.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.743 -1.223 . . . . 0.0 109.512 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.423 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.9 mt-10 -65.64 -43.57 89.06 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.49 -50.49 51.94 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.65 -0.656 . . . . 0.0 110.087 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -57.72 -46.38 84.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.052 -1.03 . . . . 0.0 109.167 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.21 96.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.405 -0.81 . . . . 0.0 109.941 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.0 -34.92 77.43 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.535 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -65.12 -48.13 84.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.72 -37.57 84.68 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.952 -1.092 . . . . 0.0 108.256 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.41 -33.0 86.07 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.6 p-10 -93.11 -31.77 14.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.797 -1.413 . . . . 0.0 110.267 -179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.6 mtp180 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 120.761 -1.212 . . . . 0.0 109.521 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.59 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 24.9 mm-40 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.34 -51.31 70.36 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.175 -0.953 . . . . 0.0 109.388 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -63.29 -44.37 95.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.164 -0.96 . . . . 0.0 109.432 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -66.05 -48.54 70.71 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.881 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.5 -36.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.727 -1.233 . . . . 0.0 108.603 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -56.7 -39.4 73.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.495 -1.378 . . . . 0.0 107.863 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -58.34 -32.08 68.18 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 mt -71.35 -40.29 70.78 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.0 111.934 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -75.5 -32.92 60.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.452 -1.405 . . . . 0.0 110.119 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.466 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.4 mt-10 -67.08 -26.15 66.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.995 -1.066 . . . . 0.0 110.48 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.466 ' C ' ' O ' ' A' ' 18' ' ' GLU . 34.4 mt -38.36 -41.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 121.566 -0.708 . . . . 0.0 110.502 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.443 ' C ' ' OD1' ' A' ' 20' ' ' ASN . 36.5 p30 -172.71 165.65 5.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.873 -1.142 . . . . 0.0 110.309 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -91.1 69.52 6.2 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.663 -0.648 . . . . 0.0 109.63 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -112.19 103.87 55.62 Favored Pre-proline 0 N--CA 1.493 1.695 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -48.62 -42.92 35.19 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.066 1.844 . . . . 0.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -62.54 -38.03 88.44 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.276 -0.89 . . . . 0.0 108.805 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.608 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -60.54 -44.96 95.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.481 -0.762 . . . . 0.0 109.874 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.31 -53.87 48.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.226 -0.921 . . . . 0.0 109.729 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -51.77 -39.76 59.13 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.32 -60.5 3.31 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.425 -0.797 . . . . 0.0 109.933 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.7 mt -54.75 -46.91 74.38 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 109.291 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.519 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 93.6 m-20 -63.03 -47.34 83.47 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.458 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -67.09 -43.33 82.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.181 -0.949 . . . . 0.0 109.325 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.403 HD12 ' CD2' ' A' ' 109' ' ' TYR . 55.3 tp -60.25 -51.51 69.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.342 -0.849 . . . . 0.0 110.345 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.02 -35.29 74.75 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 117.75 -1.58 . . . . 0.0 107.715 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -69.74 -51.48 33.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.596 -0.69 . . . . 0.0 110.599 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -59.55 -43.92 93.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.245 -0.91 . . . . 0.0 111.92 -178.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.0 mtp -57.38 -31.33 65.69 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 111.268 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -54.13 -40.37 67.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.493 -1.38 . . . . 0.0 108.553 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -65.99 -40.19 90.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.449 -0.782 . . . . 0.0 109.186 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -63.76 -30.69 71.76 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.632 -0.667 . . . . 0.0 110.194 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.57 1.55 68.43 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 107.914 -2.075 . . . . 0.0 107.914 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.1 p -118.8 84.45 25.42 Favored Pre-proline 0 N--CA 1.487 1.411 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.9 146.08 10.23 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.622 2.214 . . . . 0.0 111.397 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 11.7 mt -79.44 95.22 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 119.126 -1.03 . . . . 0.0 109.454 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.59 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 77.5 m-20 -64.4 -43.55 94.09 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -136.42 133.38 36.61 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.98 132.49 88.49 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 120.777 -1.202 . . . . 0.0 108.714 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -58.99 140.11 93.87 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 N-CA-C 108.82 -1.262 . . . . 0.0 108.82 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 mt -106.22 146.02 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.954 -1.091 . . . . 0.0 110.839 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.405 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 82.6 mtp -143.54 121.11 11.76 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 69.18 39.45 1.71 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -178.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt 56.78 22.2 6.73 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.547 0.689 . . . . 0.0 109.576 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.1 m -132.19 150.52 52.14 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -67.65 146.72 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.832 -1.168 . . . . 0.0 108.966 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.6 118.06 17.14 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 109.778 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -62.27 93.26 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.327 -0.858 . . . . 0.0 108.95 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -54.09 -26.99 29.98 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.054 -1.029 . . . . 0.0 109.405 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -78.88 -59.34 2.82 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.118 -0.988 . . . . 0.0 111.666 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -57.41 -37.6 73.01 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.502 -1.374 . . . . 0.0 109.519 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.21 -46.66 87.87 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.433 ' O ' ' C ' ' A' ' 61' ' ' ASN . 46.2 t80 -61.28 -70.64 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.387 0.613 . . . . 0.0 109.551 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 60' ' ' TYR . 54.3 t30 -38.26 -40.83 0.56 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.657 -0.652 . . . . 0.0 111.01 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.569 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 52.0 mt -72.44 -46.67 53.98 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.356 -1.338 . . . . 0.0 108.277 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.428 HG21 ' CE2' ' A' ' 102' ' ' TYR . 18.9 t -56.37 -43.53 77.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.214 -0.929 . . . . 0.0 110.491 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.412 HG13 ' CE2' ' A' ' 60' ' ' TYR . 5.8 mm -70.42 -35.22 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.712 -1.243 . . . . 0.0 108.11 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.68 -19.68 17.7 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.765 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.618 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.3 mmt-85 -94.1 -0.38 55.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.735 -1.228 . . . . 0.0 108.234 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 14.13 80.16 Favored Glycine 0 N--CA 1.492 2.414 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.609 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 147.3 126.21 1.66 Allowed Glycine 0 N--CA 1.5 2.935 0 O-C-N 120.065 -1.844 . . . . 0.0 111.582 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.6 tp -47.33 -41.01 18.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.492 -1.005 . . . . 0.0 109.956 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.42 -42.19 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.031 -1.043 . . . . 0.0 110.197 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -54.98 -37.53 66.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 108.749 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.1 t -65.91 -43.07 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.521 -0.737 . . . . 0.0 110.502 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.9 mt -66.89 -58.65 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.701 -1.249 . . . . 0.0 110.239 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -58.64 -40.75 84.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.157 -0.964 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.4 mmtp -92.64 -10.2 38.21 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.157 -0.964 . . . . 0.0 110.614 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 72' ' ' VAL . 49.5 mttp 58.69 56.96 3.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.519 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.46 15.72 10.2 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.837 -1.164 . . . . 0.0 108.12 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.492 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.9 m95 -65.14 -40.82 94.95 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.447 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.0 mm-40 -49.06 -38.43 24.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.192 -1.403 . . . . 0.0 107.995 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.618 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.0 mt-10 -69.14 -40.86 77.98 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.9 mt -71.67 -52.48 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.492 ' N ' ' O ' ' A' ' 78' ' ' TRP . 83.8 mt -51.85 -53.75 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.633 -0.667 . . . . 0.0 110.115 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 79' ' ' GLN . 59.9 mttp -70.88 -37.56 73.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.77 -1.206 . . . . 0.0 110.019 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -54.96 -33.7 57.18 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.264 -1.535 . . . . 0.0 109.264 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.2 mt -86.7 -10.54 53.48 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.4 -1.059 . . . . 0.0 108.566 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 67.78 40.66 2.37 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.34 0.59 . . . . 0.0 110.513 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.72 141.55 79.31 Favored Pre-proline 0 N--CA 1.487 1.405 0 O-C-N 121.157 -0.964 . . . . 0.0 108.634 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.587 ' C ' ' H ' ' A' ' 90' ' ' SER . 39.8 Cg_endo -71.59 142.03 39.31 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 121.979 1.786 . . . . 0.0 112.076 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.0 p -55.73 0.01 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.587 ' H ' ' C ' ' A' ' 88' ' ' PRO . 20.4 m -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.077 -1.015 . . . . 0.0 109.937 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 91' ' ' ILE . 81.3 mt -92.86 101.57 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 120.781 -1.199 . . . . 0.0 109.258 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -71.26 -29.53 65.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.226 -0.921 . . . . 0.0 109.179 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.3 m -96.32 40.07 1.14 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.46 -0.775 . . . . 0.0 109.472 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -62.6 1.51 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.945 . . . . 0.0 108.721 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.6 -51.06 22.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.289 -0.882 . . . . 0.0 109.694 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.1 tp -58.53 -41.22 85.0 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.603 -1.31 . . . . 0.0 108.61 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.584 ' O ' ' NE2' ' A' ' 101' ' ' GLN . 35.8 m -63.87 -41.31 97.78 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.272 -0.893 . . . . 0.0 109.271 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mt -68.49 -46.35 69.92 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.266 -0.896 . . . . 0.0 110.692 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.731 ' NH1' HD22 ' A' ' 129' ' ' ASN . 34.6 ttp180 -68.17 -48.57 64.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.137 -0.977 . . . . 0.0 110.833 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.9 m -55.54 -53.54 55.13 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.058 -1.026 . . . . 0.0 110.017 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.584 ' NE2' ' O ' ' A' ' 97' ' ' THR . 8.4 mt-30 -64.68 -41.19 96.23 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.954 -1.091 . . . . 0.0 111.548 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.428 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.3 t80 -57.23 -41.98 80.56 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 120.317 -1.489 . . . . 0.0 109.007 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.446 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 83.1 mtp -54.24 -57.69 10.23 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-O 121.471 0.653 . . . . 0.0 112.246 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -71.17 -51.47 24.67 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.414 -1.429 . . . . 0.0 112.099 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.426 ' CD1' ' N ' ' A' ' 105' ' ' TYR . 60.6 m-85 -84.67 -46.14 11.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -175.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.47 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.9 mp -103.13 11.97 36.41 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.355 -1.466 . . . . 0.0 113.835 -176.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.541 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.5 t80 -68.79 -38.4 11.65 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 119.903 -1.748 . . . . 0.0 111.492 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 86.9 Cg_endo -79.1 -41.57 0.22 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.535 1.49 . . . . 0.0 112.514 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.403 ' CD2' HD12 ' A' ' 32' ' ' LEU . 10.9 t80 -58.47 -41.92 86.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.856 -1.152 . . . . 0.0 107.975 178.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -70.65 -49.58 45.9 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.443 0.64 . . . . 0.0 110.213 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.516 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.5 t -74.82 -44.43 49.33 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.379 -0.826 . . . . 0.0 110.675 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.0 tp10 -66.4 -46.05 77.93 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.347 -0.846 . . . . 0.0 111.061 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -75.08 -33.2 61.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.039 -1.038 . . . . 0.0 111.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.02 -25.18 3.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.844 -1.16 . . . . 0.0 112.133 -177.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.0 t-20 59.26 50.7 7.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.579 -1.326 . . . . 0.0 110.506 178.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 26.2 mt -68.37 -32.17 72.06 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.346 -0.847 . . . . 0.0 111.839 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 10.0 t -154.66 -167.02 2.48 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 118.465 -1.294 . . . . 0.0 111.502 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.7 p -123.77 160.3 52.02 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 121.771 -0.58 . . . . 0.0 109.574 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -59.98 -38.69 76.75 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.348 1.365 . . . . 0.0 112.007 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.56 86.71 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.987 -1.071 . . . . 0.0 109.561 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.25 -48.37 67.95 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.8 tp -63.22 -53.2 56.85 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.486 -0.759 . . . . 0.0 109.92 179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -57.76 -44.33 86.09 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.002 -1.061 . . . . 0.0 109.235 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.18 91.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.738 . . . . 0.0 111.074 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -69.2 -32.08 71.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.027 -1.046 . . . . 0.0 109.17 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.684 ' CG2' ' NH2' ' A' ' 130' ' ' ARG . 12.0 mt -63.58 -49.42 82.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.001 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.17 -35.93 78.82 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.45 -17.9 67.04 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.731 HD22 ' NH1' ' A' ' 99' ' ' ARG . 17.2 p-10 -94.3 -30.58 14.46 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.842 -1.387 . . . . 0.0 110.644 -179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.684 ' NH2' ' CG2' ' A' ' 126' ' ' ILE . 1.1 mtt-85 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 120.65 -1.281 . . . . 0.0 110.112 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 20.5 mm-40 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 120.883 0.373 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.02 -46.67 84.91 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.291 -0.881 . . . . 0.0 109.826 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -62.27 -43.69 98.25 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.009 -1.057 . . . . 0.0 109.54 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -65.91 -50.21 65.25 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.457 -0.777 . . . . 0.0 111.09 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.415 ' CG1' ' O ' ' A' ' 9' ' ' GLN . 2.2 p -68.15 -39.02 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.705 -1.247 . . . . 0.0 109.455 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.52 -38.35 87.06 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.274 -1.516 . . . . 0.0 107.757 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -32.41 64.42 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.085 -1.046 . . . . 0.0 108.179 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.5 mt -66.85 -41.2 87.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.316 -0.865 . . . . 0.0 111.734 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.426 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 97.5 m-85 -75.7 -36.59 59.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.363 -1.461 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -70.3 -3.86 19.27 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.072 -1.018 . . . . 0.0 110.97 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.451 ' CG2' ' NH1' ' A' ' 25' ' ' ARG . 8.9 mt -56.66 -41.42 74.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 O-C-N 121.236 -0.915 . . . . 0.0 109.467 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -171.85 166.41 6.43 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.058 -1.026 . . . . 0.0 110.397 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.496 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.9 p30 -89.22 67.27 7.86 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.641 -0.662 . . . . 0.0 110.835 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.43 ' C ' ' OD1' ' A' ' 22' ' ' ASP . 8.8 t0 -112.17 95.41 30.15 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.12 -41.65 33.65 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 122.207 1.938 . . . . 0.0 112.794 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -62.56 -40.03 95.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.908 -1.12 . . . . 0.0 108.752 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.577 HH22 ' CG ' ' A' ' 55' ' ' ASP . 63.1 ttt180 -59.69 -36.12 75.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 110.11 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -60.15 -52.94 63.17 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.403 -0.811 . . . . 0.0 109.354 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -52.65 -38.3 60.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.471 -0.768 . . . . 0.0 109.971 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -64.48 -59.74 3.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.081 -1.012 . . . . 0.0 110.81 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 50.7 mt -52.93 -47.91 67.7 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.041 -1.037 . . . . 0.0 108.791 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.426 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 30.1 m-20 -61.93 -45.14 95.01 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.418 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.1 -46.73 73.33 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.218 -0.926 . . . . 0.0 109.843 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.5 tp -57.21 -47.78 80.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.224 -0.922 . . . . 0.0 110.276 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.7 m-85 -61.89 -36.6 81.78 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.19 -1.404 . . . . 0.0 107.679 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -70.24 -53.12 18.31 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.564 -0.71 . . . . 0.0 109.975 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -59.2 -42.08 90.06 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.375 -0.828 . . . . 0.0 111.172 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mmm -57.23 -34.85 68.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.944 . . . . 0.0 110.443 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -54.63 -39.92 68.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 109.362 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -74.89 -30.21 61.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 108.793 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -65.72 -30.85 71.58 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.742 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.93 -0.63 69.78 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.5 p -116.68 84.48 15.4 Favored Pre-proline 0 N--CA 1.488 1.468 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -83.14 139.03 9.25 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 122.558 2.172 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.9 mt -73.75 96.76 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.091 -1.005 . . . . 0.0 110.246 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 81.9 m-20 -60.52 -33.99 73.44 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -158.98 139.24 12.24 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -70.92 125.37 92.0 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.032 -1.043 . . . . 0.0 110.157 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -53.21 139.52 62.99 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.7 mt -103.11 146.7 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.867 -1.146 . . . . 0.0 110.714 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.2 mmm -137.41 127.06 25.27 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 56.85 42.89 25.83 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.93 24.51 12.64 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.365 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -135.05 153.84 51.92 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.182 -0.949 . . . . 0.0 109.324 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.2 m -67.27 142.09 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 120.983 -1.073 . . . . 0.0 109.387 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.8 tp -75.16 123.48 25.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.307 -0.871 . . . . 0.0 110.012 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.577 ' CG ' HH22 ' A' ' 25' ' ' ARG . 38.5 m-20 -59.56 99.96 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.521 -0.737 . . . . 0.0 109.719 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.6 -30.32 71.25 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.074 -1.016 . . . . 0.0 109.234 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -80.85 -60.56 2.26 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.291 -0.881 . . . . 0.0 111.578 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -54.1 -38.16 65.07 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.666 -1.271 . . . . 0.0 108.584 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.95 -46.37 89.64 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE2' HG13 ' A' ' 64' ' ' ILE . 54.0 t80 -59.37 -66.38 0.52 Allowed 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 121.485 0.659 . . . . 0.0 109.731 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -42.92 -42.11 3.59 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.582 -0.699 . . . . 0.0 111.552 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.99 -43.63 64.78 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.059 -1.456 . . . . 0.0 108.066 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.407 HG22 ' CE2' ' A' ' 102' ' ' TYR . 36.1 t -58.98 -44.35 90.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.239 -0.913 . . . . 0.0 109.334 179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.41 HG13 ' CE2' ' A' ' 60' ' ' TYR . 15.7 mm -69.55 -38.72 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 120.738 -1.226 . . . . 0.0 108.403 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.89 -19.93 7.7 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.812 -0.555 . . . . 0.0 110.13 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.41 ' N ' ' HD2' ' A' ' 66' ' ' ARG . 7.0 mpt_? -95.06 -0.82 53.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.584 -1.323 . . . . 0.0 108.957 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.63 72.56 Favored Glycine 0 N--CA 1.492 2.404 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.263 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.1 131.52 2.46 Favored Glycine 0 N--CA 1.498 2.806 0 CA-C-N 119.722 1.761 . . . . 0.0 111.703 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 tp -52.64 -38.97 61.27 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.678 -0.895 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 77.8 t -56.15 -43.64 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.202 -0.936 . . . . 0.0 108.97 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -59.15 -40.2 84.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.166 -0.959 . . . . 0.0 110.025 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.595 ' O ' ' N ' ' A' ' 76' ' ' LYS . 60.5 t -63.64 -43.99 98.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 120.741 -1.224 . . . . 0.0 109.551 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 33.7 mt -65.04 -61.53 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 120.758 -1.214 . . . . 0.0 110.182 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -58.48 -41.38 85.17 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.156 -0.965 . . . . 0.0 110.764 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.412 ' HZ3' ' HB3' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -90.87 -10.03 44.13 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.95 -1.093 . . . . 0.0 110.261 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' VAL . 21.4 mtmm 58.69 60.66 2.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.29 -0.881 . . . . 0.0 110.951 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.0 mt -95.42 14.22 23.32 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.104 -0.998 . . . . 0.0 108.55 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' A' ' 82' ' ' ILE . 98.8 m95 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.36 -0.837 . . . . 0.0 109.03 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.445 ' C ' ' O ' ' A' ' 78' ' ' TRP . 80.5 mt-30 -48.13 -38.83 18.77 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.537 -1.352 . . . . 0.0 108.437 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.8 mm-40 -67.85 -38.61 83.35 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 178.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.3 mt -74.25 -51.41 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.505 ' N ' ' O ' ' A' ' 78' ' ' TRP . 57.3 mt -52.0 -56.05 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.49 -37.07 68.53 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.374 -0.829 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -51.85 -34.7 37.96 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.49 -4.92 55.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.373 -1.075 . . . . 0.0 109.039 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 65.72 38.98 5.01 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.642 0.734 . . . . 0.0 109.16 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.24 145.75 86.03 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.0 Cg_endo -71.06 136.68 30.11 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.281 1.987 . . . . 0.0 112.415 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 t -62.79 -0.7 0.7 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.435 ' H ' ' C ' ' A' ' 88' ' ' PRO . 77.9 p -64.64 -25.56 68.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.987 -1.07 . . . . 0.0 109.551 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.408 HG23 ' N ' ' A' ' 94' ' ' ALA . 68.5 mt -93.25 99.5 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.99 -1.069 . . . . 0.0 108.748 178.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 40.8 p -68.35 -31.12 70.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.108 -0.995 . . . . 0.0 108.851 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -88.07 29.25 0.96 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.408 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -59.23 -67.35 0.38 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.4 -0.813 . . . . 0.0 108.976 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.03 -47.54 33.51 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.644 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.8 -45.53 92.06 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.33 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 36.2 m -61.63 -39.75 92.41 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.02 -1.05 . . . . 0.0 108.616 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.8 mt -70.9 -43.99 67.19 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.509 -0.745 . . . . 0.0 109.725 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -66.24 -51.28 59.09 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.111 -0.993 . . . . 0.0 110.66 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.2 m -57.11 -54.69 43.91 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.552 -0.718 . . . . 0.0 110.996 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -62.61 -41.2 98.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.986 -1.071 . . . . 0.0 111.393 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.407 ' CE2' HG22 ' A' ' 63' ' ' VAL . 4.9 t80 -57.32 -41.63 80.29 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.545 -1.347 . . . . 0.0 109.344 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 35.3 ttm -53.81 -52.89 58.88 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.823 -0.548 . . . . 0.0 111.313 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -71.17 -54.84 9.62 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.811 -1.181 . . . . 0.0 112.732 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -84.86 -45.8 11.94 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -174.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 9.4 mp -97.4 -7.74 31.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.121 -1.612 . . . . 0.0 114.255 -175.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.634 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 26.6 t80 -57.94 -38.3 65.2 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 119.822 -1.799 . . . . 0.0 110.006 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 24.4 Cg_exo -65.0 -54.43 0.66 Allowed 'Trans proline' 0 N--CA 1.5 1.881 0 C-N-CA 122.513 2.142 . . . . 0.0 112.793 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.23 -44.07 88.04 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.178 -0.951 . . . . 0.0 108.64 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.33 -53.95 30.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 110.502 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.634 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 58.0 m -71.62 -45.09 63.11 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -0.868 . . . . 0.0 111.456 -177.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -67.67 -49.44 62.82 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.912 -1.117 . . . . 0.0 111.268 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -76.76 -23.79 52.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.995 -1.065 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -125.88 -30.96 2.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.81 -1.181 . . . . 0.0 111.416 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 111' ' ' CYS . 15.3 t30 56.32 47.02 19.96 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.92 -1.113 . . . . 0.0 110.226 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 48.5 mt -67.64 -30.28 69.8 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.003 -1.06 . . . . 0.0 111.114 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 32.1 t -153.94 -166.64 2.43 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.371 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 64.0 p -126.79 153.66 75.92 Favored Pre-proline 0 N--CA 1.497 1.903 0 O-C-N 121.711 -0.618 . . . . 0.0 109.984 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -52.08 -40.54 68.05 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.121 1.881 . . . . 0.0 112.188 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.27 89.35 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.769 -1.207 . . . . 0.0 109.727 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -65.84 -42.94 89.86 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.1 tp -65.69 -53.59 38.92 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.576 -0.702 . . . . 0.0 109.937 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -56.05 -44.37 78.78 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.55 75.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.54 -36.12 73.51 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.752 0.786 . . . . 0.0 108.954 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 34.0 mt -59.05 -52.89 55.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -67.0 -37.7 84.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.509 -0.744 . . . . 0.0 109.327 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.15 -30.11 72.89 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.698 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -95.82 -36.36 11.16 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.916 -1.344 . . . . 0.0 110.505 -178.893 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.698 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.7 mtp180 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 120.85 -1.156 . . . . 0.0 110.295 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.562 ' NE2' ' C ' ' A' ' 44' ' ' ASN . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.415 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -55.15 -49.4 71.92 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.363 -0.836 . . . . 0.0 109.62 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -61.6 -38.73 88.68 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.92 -1.113 . . . . 0.0 109.176 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -65.21 -52.56 53.94 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.482 -0.761 . . . . 0.0 111.13 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -70.53 -35.95 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.989 -1.069 . . . . 0.0 109.62 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -60.05 -38.73 83.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.305 -1.497 . . . . 0.0 107.894 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.405 ' CA ' HE21 ' A' ' 15' ' ' GLN . 0.4 OUTLIER -58.93 -31.87 69.05 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 178.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.44 -36.41 81.16 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.436 -0.79 . . . . 0.0 110.964 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.463 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 81.5 m-85 -82.32 -38.62 24.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.375 -1.453 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.6 -30.25 71.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.067 -1.021 . . . . 0.0 111.032 -177.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.482 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 8.1 mt -38.02 -37.08 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 O-C-N 121.567 -0.708 . . . . 0.0 110.363 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.3 m120 -170.31 159.68 7.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.952 -1.093 . . . . 0.0 109.78 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.2 64.82 4.56 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.736 -0.603 . . . . 0.0 109.525 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.94 137.55 20.15 Favored Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -71.81 -61.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.029 1.819 . . . . 0.0 112.198 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -59.35 -37.84 78.89 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.224 -0.923 . . . . 0.0 109.649 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -56.84 -42.39 79.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.646 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -60.9 -54.23 47.65 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.154 -0.966 . . . . 0.0 108.834 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -53.42 -36.17 61.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.591 -0.693 . . . . 0.0 109.633 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -61.42 -62.91 1.49 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.344 -0.847 . . . . 0.0 110.816 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.4 mt -57.13 -44.45 83.36 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.515 -0.741 . . . . 0.0 109.55 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.463 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 30.6 m-20 -63.4 -45.9 88.9 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.352 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -66.43 -42.37 87.82 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.114 -0.991 . . . . 0.0 109.008 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 109' ' ' TYR . 58.0 tp -57.97 -50.51 73.15 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.322 -0.861 . . . . 0.0 110.169 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -60.83 -34.08 74.01 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 117.988 -1.485 . . . . 0.0 107.971 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.5 m -68.88 -50.16 52.06 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.092 -1.005 . . . . 0.0 108.942 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.1 -43.27 95.7 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 111.103 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.7 mmm -58.22 -35.79 72.18 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.229 -0.92 . . . . 0.0 110.84 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -59.19 -40.33 85.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.695 -1.253 . . . . 0.0 108.853 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -64.73 -40.91 96.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.332 -0.855 . . . . 0.0 109.396 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.4 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -65.2 -30.11 70.98 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.898 -0.501 . . . . 0.0 110.412 -178.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 1.13 64.63 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 107.775 -2.13 . . . . 0.0 107.775 -178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.4 p -116.56 85.23 16.22 Favored Pre-proline 0 N--CA 1.488 1.434 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -83.53 148.47 12.72 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.733 2.289 . . . . 0.0 111.716 -179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.472 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 46.0 mt -87.52 101.42 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.037 -1.039 . . . . 0.0 110.195 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.562 ' C ' ' NE2' ' A' ' 9' ' ' GLN . 84.9 m-20 -85.95 -0.77 56.31 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.311 -0.868 . . . . 0.0 109.026 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.59 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -171.79 120.23 0.46 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.507 -0.745 . . . . 0.0 109.206 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -72.09 118.9 71.21 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.054 -1.029 . . . . 0.0 109.316 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -49.72 128.29 20.94 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 N-CA-C 108.831 -1.257 . . . . 0.0 108.831 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.411 HG23 ' N ' ' A' ' 49' ' ' MET . 60.4 mt -95.71 144.19 10.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.134 -0.979 . . . . 0.0 110.608 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.411 ' N ' HG23 ' A' ' 48' ' ' ILE . 79.4 mtp -135.09 122.1 21.26 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.87 39.83 3.27 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 58.6 24.4 12.0 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.252 0.549 . . . . 0.0 110.247 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.2 p -136.64 152.75 50.77 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.189 -0.945 . . . . 0.0 109.445 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.9 m -67.39 144.99 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 120.973 -1.079 . . . . 0.0 109.216 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.3 tp -74.16 120.49 19.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 110.028 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -63.05 91.8 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.341 -0.85 . . . . 0.0 109.09 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.06 -26.22 59.99 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.145 -0.972 . . . . 0.0 110.096 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.444 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 44.3 t80 -81.02 -57.03 3.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.066 -1.021 . . . . 0.0 111.586 -178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.43 -37.87 79.21 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.564 -1.335 . . . . 0.0 109.411 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.3 tp -59.83 -45.99 90.65 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 43.3 t80 -57.26 -66.64 0.42 Allowed 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.522 0.677 . . . . 0.0 109.41 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 74.6 m-20 -41.43 -41.13 1.94 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.689 -0.632 . . . . 0.0 111.219 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.44 -43.14 64.2 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 118.234 -1.386 . . . . 0.0 107.689 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.4 HG22 ' CE2' ' A' ' 102' ' ' TYR . 43.7 t -59.39 -44.75 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.874 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.424 HG21 HD13 ' A' ' 64' ' ' ILE . 8.6 mm -69.51 -36.86 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.663 -1.273 . . . . 0.0 108.318 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.1 -22.81 11.88 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.848 -0.533 . . . . 0.0 110.27 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.463 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.0 mpt_? -92.93 -0.22 57.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.614 -1.304 . . . . 0.0 108.753 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.98 17.99 68.55 Favored Glycine 0 N--CA 1.49 2.252 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.818 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 141.24 129.38 2.48 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 120.548 -1.56 . . . . 0.0 111.259 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.6 tp -50.36 -40.64 49.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.677 -0.896 . . . . 0.0 110.361 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.2 t -57.75 -42.14 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.861 -1.149 . . . . 0.0 109.871 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -55.94 -40.12 72.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.914 -1.116 . . . . 0.0 108.909 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 94.0 t -65.06 -41.29 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 110.157 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.47 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 49.3 mt -67.59 -56.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 O-C-N 120.775 -1.203 . . . . 0.0 109.734 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -57.69 -42.03 82.84 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.136 -0.977 . . . . 0.0 110.184 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -92.23 -10.21 39.38 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.253 -0.904 . . . . 0.0 110.452 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 3.5 mtmp? 58.54 59.08 3.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.385 -0.822 . . . . 0.0 110.05 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.1 mt -90.88 15.37 11.46 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.014 -1.054 . . . . 0.0 108.545 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.693 ' HE1' HH12 ' A' ' 99' ' ' ARG . 99.0 m95 -63.26 -37.56 87.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 108.923 178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.509 ' NE2' ' H ' ' A' ' 79' ' ' GLN . 3.6 mp0 -48.9 -40.82 31.35 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.439 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.511 ' O ' ' N ' ' A' ' 84' ' ' GLY . 81.3 mm-40 -69.05 -38.85 79.34 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt -71.28 -53.46 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.416 ' N ' ' O ' ' A' ' 78' ' ' TRP . 76.3 mt -53.19 -52.83 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -73.58 -40.29 64.0 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.292 -0.88 . . . . 0.0 109.889 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.05 -34.18 46.06 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' C ' ' CD2' ' A' ' 86' ' ' HIS . 87.7 mt -88.48 -7.2 56.94 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.287 -1.125 . . . . 0.0 108.886 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.448 ' CD2' ' C ' ' A' ' 85' ' ' LEU . 12.8 m-70 69.15 36.67 2.34 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.576 0.703 . . . . 0.0 109.245 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -73.3 121.01 84.06 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.359 -0.838 . . . . 0.0 109.198 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.493 ' C ' ' H ' ' A' ' 90' ' ' SER . 45.9 Cg_exo -50.08 139.62 34.06 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.669 1.579 . . . . 0.0 112.23 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 p -63.44 0.87 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 109.619 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.493 ' H ' ' C ' ' A' ' 88' ' ' PRO . 89.1 p -65.04 -24.49 67.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.935 -178.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.421 HG22 ' N ' ' A' ' 94' ' ' ALA . 86.6 mt -95.72 98.43 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.948 -1.095 . . . . 0.0 108.894 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 30.6 p -68.36 -28.51 67.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -0.92 . . . . 0.0 108.803 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.8 m -90.5 30.54 1.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.421 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -62.26 -65.9 0.62 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.855 . . . . 0.0 108.986 -179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.92 -50.7 33.95 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 109.179 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.03 -45.66 86.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.851 -1.156 . . . . 0.0 108.978 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.9 m -60.67 -40.02 90.56 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.174 -0.954 . . . . 0.0 108.845 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -72.56 -44.49 62.02 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.452 -0.78 . . . . 0.0 110.152 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.693 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.6 ttm-85 -65.99 -52.86 45.65 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.176 -0.953 . . . . 0.0 110.739 -179.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.1 m -57.05 -52.73 64.11 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.43 -0.794 . . . . 0.0 110.778 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -62.34 -40.67 97.13 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.127 -0.983 . . . . 0.0 111.142 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.4 ' CE2' HG22 ' A' ' 63' ' ' VAL . 3.4 t80 -57.92 -39.49 78.1 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 120.55 -1.344 . . . . 0.0 109.038 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.9 ttm -53.96 -56.49 17.34 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.548 -0.72 . . . . 0.0 111.877 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -72.42 -52.18 17.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.479 -1.388 . . . . 0.0 113.032 -176.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -85.33 -50.96 6.9 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -174.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.448 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 10.0 mp -96.52 6.05 49.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.338 -1.476 . . . . 0.0 113.751 -176.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.598 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 78.0 t80 -68.42 -37.15 9.83 Favored Pre-proline 0 C--N 1.3 -1.545 0 O-C-N 120.013 -1.68 . . . . 0.0 111.666 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.1 Cg_endo -80.28 -39.52 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.333 1.356 . . . . 0.0 111.688 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.416 ' CD2' HD11 ' A' ' 32' ' ' LEU . 13.6 t80 -59.47 -39.84 84.99 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -72.68 -53.91 10.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.482 -0.761 . . . . 0.0 109.909 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.59 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.8 t -70.56 -44.25 67.81 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.294 -0.879 . . . . 0.0 110.739 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.3 tp10 -66.79 -47.87 70.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 120.759 -1.213 . . . . 0.0 110.851 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -75.97 -28.17 57.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 111.158 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 44.3 tptt -125.32 -26.55 3.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.064 -1.022 . . . . 0.0 111.811 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.5 OUTLIER 57.72 45.67 18.5 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.644 -1.285 . . . . 0.0 110.048 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.6 mt -68.4 -32.61 72.79 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.203 -0.935 . . . . 0.0 110.958 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.711 ' HG ' ' H ' ' A' ' 118' ' ' THR . 42.9 t -155.79 -166.93 2.34 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.633 -1.227 . . . . 0.0 111.94 -178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.711 ' H ' ' HG ' ' A' ' 117' ' ' SER . 70.5 p -120.55 153.65 56.53 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -179.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.598 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 14.7 Cg_endo -59.35 -38.17 86.09 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.876 1.717 . . . . 0.0 112.186 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.07 85.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.051 -1.031 . . . . 0.0 109.319 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.505 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.9 mt-10 -66.81 -42.73 85.4 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.47 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 11.5 tp -64.74 -52.85 54.87 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 109.431 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -57.89 -46.43 84.92 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.201 -0.937 . . . . 0.0 109.065 178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.8 -42.72 98.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.38 -0.825 . . . . 0.0 110.152 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.53 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.061 -1.024 . . . . 0.0 108.342 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 4.1 mt -65.47 -49.25 79.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 130' ' ' ARG . 89.8 m-20 -61.09 -38.3 85.78 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.66 -30.87 78.1 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.66 ' C ' HD21 ' A' ' 129' ' ' ASN . 0.0 OUTLIER -90.59 -34.28 15.55 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.981 -1.305 . . . . 0.0 110.902 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.66 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 67.6 mtm180 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 120.625 -1.297 . . . . 0.0 109.513 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.6 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.9 mm-40 . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.3 -49.57 66.72 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.88 . . . . 0.0 109.768 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -61.56 -37.61 84.47 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.162 -0.961 . . . . 0.0 109.275 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -65.77 -53.32 42.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.166 -0.959 . . . . 0.0 110.956 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -72.76 -36.16 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.995 -1.066 . . . . 0.0 109.707 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -60.99 -40.99 95.57 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.261 -1.524 . . . . 0.0 108.421 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -59.05 -30.73 68.26 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.231 -0.918 . . . . 0.0 108.733 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.0 mt -67.31 -33.88 76.19 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.922 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.589 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 68.8 m-85 -83.96 -40.9 17.91 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.636 -1.29 . . . . 0.0 110.723 -179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.8 mm-40 -57.42 -32.23 66.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.054 -1.029 . . . . 0.0 109.322 -177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 5.2 mt -44.62 -43.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 O-C-N 121.423 -0.798 . . . . 0.0 109.721 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 3.9 m120 -178.04 123.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.123 -0.986 . . . . 0.0 109.781 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.495 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 51.6 p30 -86.1 68.78 10.4 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.554 -0.716 . . . . 0.0 110.789 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.4 130.94 39.84 Favored Pre-proline 0 C--N 1.303 -1.414 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -40.08 -64.16 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 C-N-CA 122.118 1.879 . . . . 0.0 112.984 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -63.89 -39.26 93.78 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.705 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -59.78 -45.99 90.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.845 -1.16 . . . . 0.0 110.38 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -61.0 -47.46 86.34 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.829 -1.17 . . . . 0.0 108.697 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.514 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 84.9 tt0 -53.03 -27.68 20.8 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.389 0.614 . . . . 0.0 109.784 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -71.89 -61.68 1.7 Allowed 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.114 -0.991 . . . . 0.0 111.33 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.522 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 13.6 mt -60.27 -44.68 95.11 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.383 -0.823 . . . . 0.0 111.057 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.589 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 40.9 p-10 -64.37 -46.02 85.17 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 118.931 -1.107 . . . . 0.0 109.579 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.589 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 52.5 t0 -65.74 -43.54 88.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.289 -0.882 . . . . 0.0 109.445 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -54.63 -49.09 71.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.188 -0.945 . . . . 0.0 109.578 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.522 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 51.5 m-85 -62.1 -34.62 76.67 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.75 -1.18 . . . . 0.0 107.856 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -69.3 -55.41 10.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.536 -0.728 . . . . 0.0 110.44 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 39.2 t80 -60.52 -38.3 83.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.282 -0.886 . . . . 0.0 110.929 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.4 mmm -60.15 -36.21 77.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.007 . . . . 0.0 110.946 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -57.91 -41.2 82.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.052 . . . . 0.0 110.335 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -65.01 -37.78 88.78 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.633 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -64.48 -30.11 71.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.837 -178.637 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.36 1.21 64.59 Favored Glycine 0 N--CA 1.482 1.742 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 41.9 p -114.43 84.3 9.5 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -85.11 143.16 9.01 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.514 2.143 . . . . 0.0 110.767 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 53.5 mt -80.68 99.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 120.944 -1.098 . . . . 0.0 110.008 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 80.9 m-20 -64.48 -46.83 81.35 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -138.22 133.2 32.9 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.69 147.47 94.5 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 120.84 -1.163 . . . . 0.0 109.182 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.33 106.64 1.8 Allowed 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 121.556 1.504 . . . . 0.0 109.875 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.439 HG22 HD12 ' A' ' 48' ' ' ILE . 40.6 mt -77.15 142.55 14.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.131 -0.98 . . . . 0.0 109.947 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 69.0 mmm -134.08 127.08 31.45 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.87 42.6 16.17 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 59.65 25.61 14.57 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.205 0.526 . . . . 0.0 110.409 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 95.3 p -138.02 153.53 49.37 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.129 -0.982 . . . . 0.0 109.758 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.2 m -66.88 145.07 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.027 -1.046 . . . . 0.0 109.178 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.1 tp -79.7 125.31 29.48 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.366 -0.834 . . . . 0.0 109.999 -179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -68.35 89.6 0.34 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.404 -0.81 . . . . 0.0 109.301 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -52.03 -22.68 4.27 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.313 -0.867 . . . . 0.0 109.595 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.545 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 48.7 t80 -77.72 -55.38 5.39 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.06 -1.025 . . . . 0.0 111.66 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -61.81 -39.94 93.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.765 -1.209 . . . . 0.0 110.44 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 52.6 tp -59.55 -43.45 93.52 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 120.732 -1.23 . . . . 0.0 108.263 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE2' HG13 ' A' ' 64' ' ' ILE . 50.2 t80 -59.29 -66.75 0.46 Allowed 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.484 0.659 . . . . 0.0 109.653 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 71.8 m-20 -42.54 -39.48 2.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.61 -0.681 . . . . 0.0 110.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.47 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.6 mt -72.5 -44.74 61.84 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.448 -1.301 . . . . 0.0 107.851 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 102' ' ' TYR . 40.8 t -58.8 -45.49 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.135 -0.978 . . . . 0.0 110.16 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.408 HD11 HG23 ' A' ' 64' ' ' ILE . 7.7 mm -67.72 -35.5 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.681 -1.262 . . . . 0.0 108.412 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.431 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.85 -25.15 26.79 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 120.261 -0.575 . . . . 0.0 110.073 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.566 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.8 mpt_? -91.17 -2.79 57.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.574 -1.329 . . . . 0.0 108.953 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.74 18.72 61.1 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.14 178.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.68 133.6 3.15 Favored Glycine 0 N--CA 1.501 3.031 0 CA-C-N 119.297 1.548 . . . . 0.0 111.41 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.9 tp -51.13 -39.01 55.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.727 -0.866 . . . . 0.0 110.305 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.94 -43.3 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.037 -1.04 . . . . 0.0 109.543 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -58.05 -39.57 78.8 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.991 -1.068 . . . . 0.0 110.171 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 76' ' ' LYS . 52.2 t -64.13 -43.58 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.38 -0.825 . . . . 0.0 110.291 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.419 HG22 HD11 ' A' ' 73' ' ' ILE . 80.8 mt -66.03 -57.92 8.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 O-C-N 120.655 -1.278 . . . . 0.0 110.249 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -58.26 -41.34 84.05 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.174 -0.954 . . . . 0.0 110.415 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -92.61 -9.09 42.29 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.144 -0.973 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.0 mttp 57.67 57.3 4.34 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 -178.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.7 mt -90.71 15.48 11.0 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 120.951 -1.093 . . . . 0.0 108.244 178.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.427 ' O ' ' C ' ' A' ' 79' ' ' GLN . 91.4 m95 -65.69 -40.27 92.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.5 -0.75 . . . . 0.0 109.121 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.545 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 5.4 mp0 -49.11 -38.71 25.63 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.389 -1.324 . . . . 0.0 108.16 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.566 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.7 mt-10 -69.76 -41.27 75.39 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.21 -52.69 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.0 mt -50.95 -56.57 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.557 -0.714 . . . . 0.0 109.139 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -70.22 -37.23 74.99 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.169 -0.957 . . . . 0.0 110.087 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.95 -32.73 34.94 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.0 mt -92.21 -7.07 49.32 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.365 -1.08 . . . . 0.0 109.135 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 68.09 40.97 2.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.746 -0.596 . . . . 0.0 110.122 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.27 140.45 85.21 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.102 -0.999 . . . . 0.0 108.844 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 44.3 Cg_endo -70.69 141.57 41.76 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 122.181 1.92 . . . . 0.0 112.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.8 p -55.83 -0.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.399 -0.813 . . . . 0.0 109.845 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 84.4 p -66.51 -26.82 67.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.168 -0.958 . . . . 0.0 109.947 -178.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.439 HD12 HG23 ' A' ' 91' ' ' ILE . 80.3 mt -98.68 102.93 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.86 -1.15 . . . . 0.0 109.353 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.3 p -74.73 -27.79 60.51 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.044 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.5 m -94.2 37.82 1.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.475 -0.766 . . . . 0.0 109.196 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.69 -65.09 0.74 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.32 -0.862 . . . . 0.0 108.903 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.62 -51.7 20.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -0.894 . . . . 0.0 109.619 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.481 ' O ' ' OG1' ' A' ' 100' ' ' THR . 5.8 tp -58.73 -43.89 90.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.934 -1.104 . . . . 0.0 109.173 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -62.69 -41.22 99.0 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.036 -1.04 . . . . 0.0 108.827 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.61 -43.08 81.31 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.428 -0.795 . . . . 0.0 109.509 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.707 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.7 ttm180 -68.62 -51.45 42.13 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.338 -0.851 . . . . 0.0 111.291 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.481 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.2 m -55.17 -52.32 63.69 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.195 -0.941 . . . . 0.0 110.009 -178.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -62.87 -42.09 99.63 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.201 -0.937 . . . . 0.0 111.377 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.42 ' CE2' HG22 ' A' ' 63' ' ' VAL . 2.6 t80 -58.55 -42.23 87.41 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.453 -1.404 . . . . 0.0 110.074 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -53.36 -54.79 31.46 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.377 -0.827 . . . . 0.0 111.253 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -73.45 -54.71 7.61 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.936 -1.102 . . . . 0.0 113.068 -176.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -84.07 -46.39 12.03 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.479 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.1 mp -96.02 -5.9 40.02 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.189 -1.569 . . . . 0.0 113.631 -176.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.661 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 83.2 t80 -59.89 -37.01 44.65 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 119.966 -1.708 . . . . 0.0 110.123 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.637 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 13.4 Cg_exo -69.03 -52.86 0.35 Allowed 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.378 2.052 . . . . 0.0 112.501 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -59.91 -42.52 94.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.408 -0.807 . . . . 0.0 109.587 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -69.42 -51.53 35.52 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.35 -0.844 . . . . 0.0 110.324 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.661 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 71.4 m -70.8 -42.36 70.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.348 -0.845 . . . . 0.0 110.49 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -66.81 -51.48 55.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.837 -1.164 . . . . 0.0 111.149 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -74.28 -26.12 60.01 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.035 -1.04 . . . . 0.0 111.408 -178.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.5 tptt -125.76 -29.73 3.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.977 -1.077 . . . . 0.0 111.607 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.554 ' N ' ' O ' ' A' ' 111' ' ' CYS . 37.4 t30 55.96 45.82 23.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.685 -1.259 . . . . 0.0 109.885 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 53.3 mt -66.77 -33.14 74.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.267 -0.895 . . . . 0.0 111.174 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.496 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 10.7 t -155.57 -161.09 1.11 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 118.893 -1.123 . . . . 0.0 111.341 -178.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.468 ' H ' ' HG ' ' A' ' 117' ' ' SER . 71.1 p -125.53 164.22 33.85 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.738 -0.601 . . . . 0.0 109.66 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.495 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 16.5 Cg_exo -64.54 -36.14 44.63 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.549 1.499 . . . . 0.0 111.873 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.29 82.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.098 -1.001 . . . . 0.0 109.356 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 48.3 mt-10 -67.33 -45.22 77.06 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.403 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 14.7 tp -66.2 -50.87 62.38 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.486 -0.759 . . . . 0.0 109.501 178.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -59.05 -46.17 88.9 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.098 -1.001 . . . . 0.0 109.311 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.73 97.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.373 -0.829 . . . . 0.0 110.381 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.69 73.63 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.508 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.1 mt -66.63 -51.16 59.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.08 -39.52 94.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.467 -0.77 . . . . 0.0 109.791 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -30.56 72.16 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.707 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 28.6 p30 -89.57 -24.99 21.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.335 -1.097 . . . . 0.0 110.299 -178.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.614 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.998 -1.064 . . . . 0.0 109.595 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.451 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 47.8 mt-30 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.152 0.501 . . . . 0.0 109.81 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -48.56 -49.28 37.19 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 109.791 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -61.76 -40.04 93.75 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.418 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -67.42 -53.24 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.368 -0.833 . . . . 0.0 111.549 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.1 p -69.69 -38.72 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.038 -1.039 . . . . 0.0 110.197 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -60.72 -39.28 88.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.125 -1.61 . . . . 0.0 108.258 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -29.44 65.89 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.229 -0.92 . . . . 0.0 108.68 178.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.6 mt -69.75 -40.22 76.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.44 -0.787 . . . . 0.0 111.464 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.455 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 91.4 m-85 -75.22 -36.83 61.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.402 -1.436 . . . . 0.0 109.864 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.481 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -62.32 -28.13 69.52 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 110.81 -177.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.481 ' C ' ' O ' ' A' ' 18' ' ' GLU . 23.3 mt -37.43 -41.42 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 O-C-N 121.602 -0.686 . . . . 0.0 110.738 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.588 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.82 168.18 5.08 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.733 -1.229 . . . . 0.0 110.598 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -90.97 65.5 5.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.614 -0.678 . . . . 0.0 110.526 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.65 137.3 20.21 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.201 -0.937 . . . . 0.0 108.563 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.88 -61.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.078 1.852 . . . . 0.0 112.262 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -34.89 71.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.132 -0.98 . . . . 0.0 109.581 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.501 HH22 ' CG ' ' A' ' 55' ' ' ASP . 59.6 ttt180 -58.48 -42.22 87.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.179 -0.95 . . . . 0.0 110.166 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -60.29 -53.29 59.36 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.86 -1.136 . . . . 0.0 108.482 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.22 -35.55 60.05 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.567 -0.708 . . . . 0.0 109.244 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -64.45 -61.84 1.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.448 -0.783 . . . . 0.0 110.995 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.7 mt -55.07 -46.96 75.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.915 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.455 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 39.1 m-20 -62.65 -46.64 87.29 Favored 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.492 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -67.17 -43.59 81.86 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.018 -1.051 . . . . 0.0 109.448 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.9 tp -56.32 -50.59 71.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 -179.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -61.78 -34.13 75.32 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.108 -1.437 . . . . 0.0 107.709 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.4 m -69.51 -53.02 21.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 109.553 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.41 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 60.0 t80 -59.14 -44.0 92.05 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.499 -0.751 . . . . 0.0 110.304 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 73.4 mmm -59.03 -37.46 77.03 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.666 -0.646 . . . . 0.0 110.462 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -59.39 -41.53 89.59 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.095 -1.003 . . . . 0.0 109.97 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.62 -46.34 79.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.469 HH11 ' HB2' ' A' ' 108' ' ' PRO . 2.8 mtp180 -62.59 -23.68 67.16 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.336 -0.852 . . . . 0.0 110.719 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.41 2.08 60.45 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 68.2 p -117.24 83.36 15.72 Favored Pre-proline 0 N--CA 1.493 1.693 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -86.98 145.62 7.58 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.987 2.458 . . . . 0.0 111.7 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.451 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 47.6 mt -79.86 98.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.082 -1.011 . . . . 0.0 109.142 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 19.8 m120 -63.14 -45.14 93.35 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -138.51 134.91 34.53 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.0 mt -70.93 144.62 90.64 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.816 -1.178 . . . . 0.0 109.463 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.78 116.29 4.66 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 121.587 1.524 . . . . 0.0 109.425 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.435 HD13 HG23 ' A' ' 48' ' ' ILE . 52.7 mt -82.59 144.19 10.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.001 -1.062 . . . . 0.0 110.061 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.417 ' N ' HG21 ' A' ' 48' ' ' ILE . 46.9 mmm -139.59 124.97 19.06 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.7 41.06 3.09 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.3 mttm 59.16 22.69 10.89 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.342 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.5 p -140.02 157.43 45.68 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.987 -1.071 . . . . 0.0 110.133 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.7 m -66.73 144.3 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 120.964 -1.085 . . . . 0.0 109.019 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.0 tp -78.63 124.07 27.79 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.364 -0.835 . . . . 0.0 109.767 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.501 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.0 m-20 -65.74 90.68 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.441 -0.787 . . . . 0.0 109.246 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 mt -55.44 -23.85 27.53 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.075 -1.016 . . . . 0.0 109.186 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -80.31 -57.94 3.37 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.179 -0.951 . . . . 0.0 111.58 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.7 -38.78 79.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.55 -1.344 . . . . 0.0 108.88 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.7 tp -58.18 -46.2 86.16 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.403 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.5 t80 -59.45 -66.18 0.55 Allowed 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.453 0.644 . . . . 0.0 109.303 178.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -42.04 -40.77 2.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.508 -0.745 . . . . 0.0 110.571 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.1 mt -71.69 -45.73 60.97 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.011 -1.476 . . . . 0.0 107.797 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.435 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.3 t -56.18 -45.07 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.137 -0.977 . . . . 0.0 110.253 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.416 HG21 HD11 ' A' ' 64' ' ' ILE . 9.7 mm -67.99 -35.98 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.665 -1.272 . . . . 0.0 107.894 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.31 -20.79 45.93 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.621 HH21 ' CB ' ' A' ' 80' ' ' GLU . 21.2 mmt-85 -93.88 0.81 56.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.579 -1.326 . . . . 0.0 108.443 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.39 13.62 73.12 Favored Glycine 0 N--CA 1.492 2.395 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.981 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.42 135.92 3.42 Favored Glycine 0 N--CA 1.502 3.058 0 CA-C-N 119.366 1.583 . . . . 0.0 111.391 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.0 tp -52.42 -39.62 61.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.553 -0.969 . . . . 0.0 110.374 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 85.3 t -58.74 -45.1 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.02 -1.05 . . . . 0.0 109.772 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.33 -39.16 69.65 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.029 -1.045 . . . . 0.0 108.651 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.8 t -63.94 -41.23 91.84 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.506 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.401 HG12 ' NH1' ' A' ' 99' ' ' ARG . 64.0 mt -66.96 -61.86 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 O-C-N 120.82 -1.175 . . . . 0.0 110.384 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -57.73 -40.16 78.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.192 -0.942 . . . . 0.0 110.215 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -91.61 -11.63 36.6 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.172 -0.955 . . . . 0.0 110.685 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.1 mtmt 58.73 60.11 2.64 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -178.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -94.63 14.44 21.03 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.935 -1.103 . . . . 0.0 108.773 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.427 ' O ' ' C ' ' A' ' 79' ' ' GLN . 81.6 m95 -62.97 -39.52 94.95 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.124 -0.985 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 78' ' ' TRP . 95.4 mm-40 -48.85 -39.39 25.46 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.379 -1.451 . . . . 0.0 108.371 178.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.621 ' CB ' HH21 ' A' ' 66' ' ' ARG . 79.0 mm-40 -66.25 -39.93 89.84 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.406 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -73.67 -50.55 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.553 -0.717 . . . . 0.0 109.211 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.404 ' N ' ' O ' ' A' ' 78' ' ' TRP . 79.7 mt -51.8 -54.02 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.509 -0.744 . . . . 0.0 109.5 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.41 -38.9 68.28 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.037 -1.04 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.74 -32.37 40.04 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.3 mt -90.47 -7.05 54.03 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.393 -1.063 . . . . 0.0 109.156 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 65.85 40.44 4.22 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.838 -0.539 . . . . 0.0 110.633 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.73 141.5 82.37 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 108.483 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.579 ' C ' ' H ' ' A' ' 90' ' ' SER . 57.6 Cg_endo -73.32 143.66 35.53 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.055 1.837 . . . . 0.0 112.532 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.7 m -58.06 1.42 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.356 -0.84 . . . . 0.0 109.664 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.579 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.6 p -66.57 -24.56 66.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.186 -0.947 . . . . 0.0 109.966 -178.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.41 HD11 HG23 ' A' ' 91' ' ' ILE . 81.6 mt -103.06 107.09 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 120.989 -1.069 . . . . 0.0 109.412 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.3 p -76.48 -28.15 56.36 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 108.729 179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 97' ' ' THR . 46.9 m -90.26 30.95 1.04 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.531 -0.731 . . . . 0.0 109.36 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.24 -64.74 0.85 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -50.57 -52.73 36.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 0.0 109.409 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.96 -44.71 91.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.825 -1.172 . . . . 0.0 108.884 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 93' ' ' SER . 55.1 m -59.06 -40.87 86.46 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.9 mt -68.75 -42.23 77.83 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.616 -0.678 . . . . 0.0 109.266 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.463 ' HG3' HH11 ' A' ' 99' ' ' ARG . 11.1 ttm-85 -65.05 -52.37 56.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.123 -0.986 . . . . 0.0 110.415 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.5 m -57.32 -53.65 55.67 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.429 -0.794 . . . . 0.0 110.341 -178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -64.79 -44.53 89.67 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.831 -1.168 . . . . 0.0 112.178 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.435 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.7 t80 -57.91 -40.12 79.62 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.087 -1.633 . . . . 0.0 108.783 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.583 ' SD ' ' CD2' ' A' ' 122' ' ' LEU . 55.8 mmm -52.55 -58.86 5.43 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.67 -0.644 . . . . 0.0 111.909 -179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -73.76 -50.8 18.89 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.559 -1.338 . . . . 0.0 112.818 -176.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -83.97 -48.53 9.86 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.9 mp -99.39 6.04 46.18 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.255 -1.528 . . . . 0.0 113.819 -176.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.528 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 36.0 t80 -66.58 -38.84 21.27 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.042 -1.661 . . . . 0.0 111.09 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.533 ' O ' ' N ' ' A' ' 112' ' ' GLU . 73.2 Cg_endo -78.64 -41.55 0.25 Allowed 'Trans proline' 0 N--CA 1.487 1.145 0 C-N-CA 121.472 1.448 . . . . 0.0 112.568 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.78 -42.62 89.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.85 -1.156 . . . . 0.0 108.348 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.96 -43.56 62.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.436 -0.79 . . . . 0.0 110.035 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.586 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.8 t -79.95 -46.27 17.01 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.1 -1.0 . . . . 0.0 110.927 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.8 tp10 -66.34 -45.62 79.6 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.737 -1.227 . . . . 0.0 110.634 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -75.34 -35.37 61.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.115 -0.99 . . . . 0.0 110.965 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -118.39 -27.15 6.06 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.012 -1.055 . . . . 0.0 111.876 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 111' ' ' CYS . 36.6 t-20 55.08 45.48 26.11 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.748 -1.22 . . . . 0.0 110.474 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 68.2 mt -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.105 -0.997 . . . . 0.0 110.561 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.477 ' OG ' ' N ' ' A' ' 118' ' ' THR . 37.8 t -153.02 -167.03 2.61 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.153 -1.019 . . . . 0.0 111.056 -178.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.477 ' N ' ' OG ' ' A' ' 117' ' ' SER . 65.5 p -127.32 159.12 67.02 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.574 -0.704 . . . . 0.0 110.171 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -55.97 -41.94 71.89 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.691 1.594 . . . . 0.0 112.665 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.6 91.81 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.878 -1.139 . . . . 0.0 109.754 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.55 -44.37 82.51 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.583 ' CD2' ' SD ' ' A' ' 103' ' ' MET . 15.2 tp -66.55 -52.41 45.93 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.664 -0.648 . . . . 0.0 110.251 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -57.64 -46.18 84.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.055 -1.028 . . . . 0.0 109.554 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.78 87.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.85 -34.55 76.92 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.285 -0.885 . . . . 0.0 108.75 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.539 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.4 mt -66.25 -49.09 78.59 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -61.68 -38.24 87.07 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.069 -1.019 . . . . 0.0 108.709 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.59 -28.71 73.57 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.9 p-10 -89.92 -30.19 18.02 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.694 -1.474 . . . . 0.0 110.335 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.655 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 O-C-N 120.886 -1.134 . . . . 0.0 109.123 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 33.3 mm-40 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 121.268 0.556 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.01 -49.76 65.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.975 -1.078 . . . . 0.0 109.649 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -62.19 -42.14 99.0 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.172 -0.955 . . . . 0.0 109.336 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -65.27 -49.76 68.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.58 -0.7 . . . . 0.0 110.805 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 m -71.74 -35.99 57.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 120.692 -1.255 . . . . 0.0 108.641 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.494 ' O ' ' OE1' ' A' ' 18' ' ' GLU . 6.9 tpt180 -54.56 -40.81 69.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.614 -1.304 . . . . 0.0 107.532 178.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -58.49 -31.4 67.81 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 mt -72.63 -37.34 68.06 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.433 -0.792 . . . . 0.0 111.469 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.509 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.5 m-85 -77.49 -33.13 54.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.364 -1.46 . . . . 0.0 110.009 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.503 ' O ' ' C ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -69.48 -27.86 65.58 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.088 -1.007 . . . . 0.0 111.282 -177.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.503 ' C ' ' O ' ' A' ' 18' ' ' GLU . 19.3 mt -35.74 -38.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.672 -0.642 . . . . 0.0 110.161 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.515 ' ND2' ' N ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -173.56 168.24 4.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.071 -1.018 . . . . 0.0 110.153 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -90.86 74.43 6.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.656 -0.653 . . . . 0.0 110.044 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -108.82 134.36 20.36 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.7 -59.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 122.079 1.853 . . . . 0.0 112.305 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -58.66 -34.18 70.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.616 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.645 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -57.09 -42.12 80.16 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.016 -1.052 . . . . 0.0 109.384 -179.613 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -61.4 -54.27 45.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.903 -1.123 . . . . 0.0 108.707 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -52.97 -37.24 61.02 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -62.47 -62.57 1.66 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.48 -0.763 . . . . 0.0 109.854 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.433 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 82.0 mt -54.8 -46.34 74.47 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 121.528 0.68 . . . . 0.0 109.72 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.509 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 98.1 m-20 -61.4 -49.65 76.01 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.003 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -66.54 -43.62 84.64 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.179 -0.95 . . . . 0.0 110.197 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.33 -52.12 64.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.967 . . . . 0.0 110.416 -178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.433 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 43.9 m-85 -62.48 -32.63 73.56 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.771 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 t -67.51 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 111.311 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.597 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -63.6 -27.32 69.16 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 111.232 -178.422 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.0 mmm -64.13 -39.55 94.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.934 -1.104 . . . . 0.0 111.057 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.09 -36.39 81.56 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.939 -1.101 . . . . 0.0 110.524 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -59.4 -50.09 75.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.211 -0.931 . . . . 0.0 111.065 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.416 HH11 ' HB3' ' A' ' 108' ' ' PRO . 28.5 mtp180 -64.19 -19.78 65.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.807 -178.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.91 3.47 55.91 Favored Glycine 0 N--CA 1.482 1.718 0 N-CA-C 108.187 -1.965 . . . . 0.0 108.187 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.1 p -117.42 83.99 17.58 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.587 -0.949 . . . . 0.0 108.943 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.66 150.36 2.3 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 123.441 2.76 . . . . 0.0 111.755 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.487 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 55.7 mt -84.87 98.19 5.96 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 120.865 -1.147 . . . . 0.0 109.153 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 25.0 m120 -79.65 -12.95 59.8 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.466 ' CG ' ' O ' ' A' ' 45' ' ' ARG . 0.5 OUTLIER -159.4 122.93 3.72 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 3.6 mt -71.46 147.1 92.41 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 120.728 -1.232 . . . . 0.0 109.349 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.82 138.14 40.15 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 121.279 1.319 . . . . 0.0 108.967 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.6 mt -105.64 146.08 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 120.9 -1.125 . . . . 0.0 110.17 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 77.9 mtp -143.26 122.37 12.9 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 69.47 39.8 1.54 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 72.6 mttt 58.15 24.49 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.478 0.656 . . . . 0.0 109.654 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 85.8 p -138.31 157.3 46.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.533 -0.729 . . . . 0.0 109.153 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -69.54 149.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.965 -1.084 . . . . 0.0 109.472 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.1 tp -82.12 124.24 29.68 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.378 -0.826 . . . . 0.0 109.741 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.41 92.94 0.07 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.592 -0.693 . . . . 0.0 110.065 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -54.34 -26.21 28.57 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 120.821 -1.174 . . . . 0.0 109.318 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -78.4 -62.6 1.63 Allowed 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.951 . . . . 0.0 111.584 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.68 -36.65 67.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.685 -1.259 . . . . 0.0 109.458 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.6 tp -61.07 -45.63 93.97 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.431 ' O ' ' C ' ' A' ' 61' ' ' ASN . 67.8 t80 -61.83 -68.13 0.35 Allowed 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.296 0.569 . . . . 0.0 109.506 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.431 ' C ' ' O ' ' A' ' 60' ' ' TYR . 57.3 t30 -42.57 -36.98 1.52 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.405 -0.809 . . . . 0.0 109.567 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.0 mt -70.42 -50.86 34.14 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.031 -1.043 . . . . 0.0 108.448 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.481 ' CG2' ' CE2' ' A' ' 102' ' ' TYR . 42.3 t -58.05 -42.59 83.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.097 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.425 HG13 ' CE2' ' A' ' 60' ' ' TYR . 11.2 mm -70.14 -34.82 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.572 -1.33 . . . . 0.0 108.151 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.412 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.33 -24.1 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.735 -0.603 . . . . 0.0 110.724 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.412 HH11 ' HB3' ' A' ' 65' ' ' ALA . 8.0 mpt_? -94.14 3.72 54.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.622 -1.298 . . . . 0.0 109.564 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 16.21 69.99 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.251 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.92 134.89 3.38 Favored Glycine 0 N--CA 1.501 2.995 0 O-C-N 120.502 -1.587 . . . . 0.0 111.424 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.412 HD12 ' CH2' ' A' ' 78' ' ' TRP . 16.1 tp -52.74 -40.18 62.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.644 -0.916 . . . . 0.0 110.863 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.6 t -57.05 -42.98 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.893 -1.129 . . . . 0.0 109.318 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -57.56 -40.39 78.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.918 -1.113 . . . . 0.0 109.538 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 78.8 t -64.69 -43.19 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.376 -0.828 . . . . 0.0 110.271 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.426 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 61.1 mt -66.33 -55.4 18.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 O-C-N 120.878 -1.139 . . . . 0.0 110.273 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -57.63 -42.39 83.3 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.159 -0.963 . . . . 0.0 110.266 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -93.58 -9.4 38.27 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.196 -0.94 . . . . 0.0 110.643 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 27.2 mtmm 58.56 60.17 2.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.409 -0.807 . . . . 0.0 109.849 -178.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.1 mt -90.88 14.94 12.34 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.525 ' O ' ' N ' ' A' ' 82' ' ' ILE . 99.0 m95 -61.27 -40.86 95.68 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.5 mt-30 -47.22 -39.9 15.1 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.748 -1.22 . . . . 0.0 108.673 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -68.54 -41.68 79.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.2 mt -69.5 -52.85 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.525 ' N ' ' O ' ' A' ' 78' ' ' TRP . 50.5 mt -53.98 -55.34 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.607 -0.683 . . . . 0.0 109.448 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 86' ' ' HIS . 68.5 mttt -68.4 -42.27 79.27 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.336 -0.853 . . . . 0.0 109.869 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.16 -31.36 26.29 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.3 mt -91.15 -7.45 51.46 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.463 -1.022 . . . . 0.0 109.037 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 83' ' ' LYS . 71.3 m-70 62.8 42.32 8.06 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.837 -0.539 . . . . 0.0 110.124 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.7 mt -71.95 137.61 82.28 Favored Pre-proline 0 N--CA 1.488 1.453 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.609 ' C ' ' H ' ' A' ' 90' ' ' SER . 31.6 Cg_endo -66.9 141.57 59.23 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.892 1.728 . . . . 0.0 112.264 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 32.5 m -55.82 1.26 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.201 -0.937 . . . . 0.0 109.995 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.609 ' H ' ' C ' ' A' ' 88' ' ' PRO . 85.4 p -65.89 -25.35 67.13 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.099 -1.001 . . . . 0.0 109.805 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.455 HD13 HG22 ' A' ' 91' ' ' ILE . 74.1 mt -100.47 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.064 -1.023 . . . . 0.0 109.205 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.4 p -76.98 -23.32 52.3 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.178 -0.951 . . . . 0.0 109.164 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.1 m -100.25 39.27 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.448 -0.783 . . . . 0.0 109.067 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.55 -63.75 1.05 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.87 . . . . 0.0 109.294 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -46.23 -51.53 14.19 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.21 -0.932 . . . . 0.0 109.612 -179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -59.01 -43.32 91.53 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.774 -1.204 . . . . 0.0 108.895 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 63.6 m -60.92 -41.24 95.77 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.992 -1.067 . . . . 0.0 108.531 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mt -70.19 -44.11 69.37 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.498 -0.751 . . . . 0.0 109.841 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.524 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.3 ttm-85 -67.0 -53.37 32.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.292 -0.88 . . . . 0.0 110.925 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 m -55.0 -50.06 69.95 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.029 -1.044 . . . . 0.0 109.335 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -64.2 -43.87 93.72 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.145 -0.972 . . . . 0.0 111.624 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.481 ' CE2' ' CG2' ' A' ' 63' ' ' VAL . 3.3 t80 -58.35 -41.42 84.64 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.422 -1.424 . . . . 0.0 109.183 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.442 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 81.5 mtp -50.91 -56.48 12.1 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.584 -0.697 . . . . 0.0 111.431 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.0 mttt -73.58 -55.92 5.69 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.933 -1.104 . . . . 0.0 113.15 -176.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -84.24 -46.4 11.87 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 115.4 1.629 . . . . 0.0 115.4 -174.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.8 mp -97.6 -4.87 36.75 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.212 -1.555 . . . . 0.0 113.177 -176.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 39.2 t80 -62.81 -36.65 27.3 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 120.074 -1.641 . . . . 0.0 109.466 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.6 Cg_exo -66.17 -52.74 0.79 Allowed 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 122.15 1.9 . . . . 0.0 111.678 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.29 -48.46 80.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.292 -0.88 . . . . 0.0 109.504 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.49 -47.77 69.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.118 -0.989 . . . . 0.0 110.368 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.6 t -73.99 -46.36 44.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.984 -1.073 . . . . 0.0 110.719 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.597 ' OE1' ' CZ ' ' A' ' 35' ' ' PHE . 35.2 tt0 -66.88 -51.89 50.0 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 120.904 -1.122 . . . . 0.0 111.304 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -74.57 -32.39 62.38 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.119 -0.988 . . . . 0.0 111.874 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -117.25 -29.69 5.82 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.895 -1.128 . . . . 0.0 111.616 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 111' ' ' CYS . 19.0 t-20 54.83 44.78 27.88 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.683 -1.261 . . . . 0.0 110.481 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.36 -28.33 67.86 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.992 -1.068 . . . . 0.0 110.903 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.651 ' HG ' ' H ' ' A' ' 118' ' ' THR . 4.5 t -153.61 -168.17 2.91 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.273 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.651 ' H ' ' HG ' ' A' ' 117' ' ' SER . 71.1 p -122.8 152.5 62.51 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.53 -178.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.637 ' N ' ' HH ' ' A' ' 107' ' ' TYR . 9.5 Cg_endo -55.02 -36.76 93.45 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 C-N-CA 122.042 1.828 . . . . 0.0 112.08 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.33 83.24 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.943 -1.098 . . . . 0.0 109.243 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.489 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.7 mt-10 -65.93 -44.49 84.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 177.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.426 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 33.0 tp -63.56 -51.79 63.85 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.727 -0.608 . . . . 0.0 109.445 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -58.01 -50.13 74.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.241 -0.912 . . . . 0.0 109.658 178.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.24 -41.4 96.83 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.41 -0.806 . . . . 0.0 110.209 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.57 74.66 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.442 ' CD1' ' SD ' ' A' ' 103' ' ' MET . 5.5 mt -63.46 -49.78 81.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.97 -36.96 82.99 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.23 -32.98 78.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.64 ' C ' HD21 ' A' ' 129' ' ' ASN . 0.2 OUTLIER -92.59 -29.47 16.13 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.016 -1.285 . . . . 0.0 110.366 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.631 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.088 -1.007 . . . . 0.0 109.855 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.48 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 35.4 mt-30 . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.83 -47.66 51.36 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.334 -0.854 . . . . 0.0 109.052 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -62.29 -41.56 98.6 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.156 -0.965 . . . . 0.0 109.6 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -65.78 -51.14 61.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.948 . . . . 0.0 110.47 -179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -70.92 -37.05 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 120.989 -1.07 . . . . 0.0 109.845 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.592 HH11 ' CG ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -61.39 -38.37 86.82 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 119.926 -1.734 . . . . 0.0 108.03 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -30.23 66.24 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.37 -39.55 77.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.459 -0.775 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.461 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -76.15 -35.44 59.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.375 -1.453 . . . . 0.0 110.158 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.3 mt-10 -62.21 -27.74 69.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.036 -1.04 . . . . 0.0 110.019 -177.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 29.9 mt -39.72 -41.01 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 121.7 -0.625 . . . . 0.0 110.346 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.8 m120 -170.32 157.87 6.38 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.07 -1.019 . . . . 0.0 109.341 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 58.4 p30 -94.15 63.25 3.11 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.3 144.28 27.8 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.165 -0.959 . . . . 0.0 108.942 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.25 -60.57 0.06 OUTLIER 'Trans proline' 0 C--N 1.312 -1.356 0 C-N-CA 122.164 1.909 . . . . 0.0 111.771 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -61.33 -36.1 79.23 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.307 -0.87 . . . . 0.0 109.493 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.559 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.3 ttt-85 -57.99 -45.98 85.92 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.978 -1.076 . . . . 0.0 109.192 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -61.46 -56.82 15.93 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.223 -0.923 . . . . 0.0 109.458 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -51.75 -35.25 42.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.498 -0.751 . . . . 0.0 109.585 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -63.17 -62.3 1.79 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 110.655 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.411 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 62.8 mt -53.23 -46.82 69.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.882 . . . . 0.0 109.322 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.461 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.1 m-20 -61.27 -46.91 88.4 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.086 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.403 -0.81 . . . . 0.0 110.067 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.405 HD12 ' CD2' ' A' ' 109' ' ' TYR . 63.5 tp -59.04 -50.06 75.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.028 -1.045 . . . . 0.0 110.733 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -63.06 -35.51 80.5 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.357 -1.337 . . . . 0.0 107.796 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 t -68.25 -52.52 32.99 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.522 -0.736 . . . . 0.0 109.702 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.61 -42.52 88.38 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.506 -0.746 . . . . 0.0 110.378 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.516 ' CE ' ' O ' ' A' ' 41' ' ' THR . 61.6 mmm -60.13 -38.59 83.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.478 -0.764 . . . . 0.0 111.027 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -57.7 -37.06 72.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.658 -1.276 . . . . 0.0 108.833 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.421 ' HA ' ' HZ2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -67.36 -47.88 69.12 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.338 -0.851 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG3' HH11 ' A' ' 39' ' ' ARG . 2.6 mmm-85 -63.63 -22.59 66.98 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.21 -0.931 . . . . 0.0 110.798 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.24 2.81 61.94 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.516 ' O ' ' CE ' ' A' ' 36' ' ' MET . 60.0 p -116.4 83.64 13.49 Favored Pre-proline 0 N--CA 1.491 1.6 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -85.32 143.81 8.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.877 2.385 . . . . 0.0 111.196 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.419 HG21 HD11 ' A' ' 43' ' ' ILE . 13.7 mt -82.87 103.45 10.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 O-C-N 120.841 -1.162 . . . . 0.0 109.818 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.48 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 90.7 m-20 -67.37 -55.82 12.2 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.572 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.1 OUTLIER -127.31 133.64 50.09 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.177 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -70.91 146.35 92.97 Favored Pre-proline 0 C--N 1.3 -1.571 0 O-C-N 121.074 -1.016 . . . . 0.0 109.59 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -70.27 132.17 21.97 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.536 1.491 . . . . 0.0 108.967 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mt -99.55 141.4 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 120.771 -1.206 . . . . 0.0 109.917 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 82.3 mtp -140.78 121.19 14.03 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 72.05 39.76 0.78 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.6 mttm 59.41 20.57 8.9 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.257 0.551 . . . . 0.0 110.161 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -139.74 159.35 42.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.093 -1.005 . . . . 0.0 109.395 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.15 146.35 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.985 -1.072 . . . . 0.0 109.414 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.7 tp -78.29 124.8 28.5 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.197 -0.94 . . . . 0.0 108.936 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.17 98.41 0.14 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.692 -0.63 . . . . 0.0 110.449 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.16 -28.0 56.41 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.97 -1.081 . . . . 0.0 108.566 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -77.68 -60.77 2.23 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.178 -0.951 . . . . 0.0 111.825 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.7 -37.87 74.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.778 -1.201 . . . . 0.0 109.257 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CZ ' HD13 ' A' ' 64' ' ' ILE . 48.8 t80 -62.13 -66.91 0.47 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.674 -0.641 . . . . 0.0 110.072 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 60' ' ' TYR . 58.1 t30 -40.02 -40.86 1.12 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.537 -0.727 . . . . 0.0 111.21 -178.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 mt -73.97 -46.67 42.48 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.031 -1.467 . . . . 0.0 108.023 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.402 HG23 ' CE2' ' A' ' 102' ' ' TYR . 37.3 t -53.97 -44.15 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.001 -1.062 . . . . 0.0 109.833 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.409 HD13 ' CZ ' ' A' ' 60' ' ' TYR . 7.3 mm -68.22 -36.47 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.685 -1.259 . . . . 0.0 107.794 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.82 -15.64 22.28 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.669 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.675 HH21 ' CB ' ' A' ' 80' ' ' GLU . 18.1 mmt-85 -98.27 1.71 47.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.346 -1.471 . . . . 0.0 108.554 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.31 13.01 74.77 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.42 -0.895 . . . . 0.0 111.572 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.87 137.29 3.73 Favored Glycine 0 N--CA 1.504 3.193 0 O-C-N 120.532 -1.569 . . . . 0.0 111.901 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 tp -51.85 -41.72 62.04 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.756 -0.85 . . . . 0.0 110.29 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.78 -43.72 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.009 -1.057 . . . . 0.0 109.413 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -57.07 -40.48 76.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.067 -1.021 . . . . 0.0 109.238 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 50.8 t -61.83 -43.41 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.45 -0.781 . . . . 0.0 109.916 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -58.55 6.34 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 O-C-N 120.711 -1.243 . . . . 0.0 110.394 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -57.74 -41.05 81.08 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.147 -0.971 . . . . 0.0 110.667 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -93.46 -9.81 37.2 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 19.2 mtmt 59.07 59.36 2.79 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.289 -0.882 . . . . 0.0 109.643 -178.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.2 mt -93.95 15.58 16.49 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.89 -1.131 . . . . 0.0 108.592 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.464 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.9 m95 -63.02 -41.68 99.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.358 -0.838 . . . . 0.0 108.924 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.0 mt-30 -48.86 -39.11 24.45 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.519 -1.363 . . . . 0.0 108.442 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.675 ' CB ' HH21 ' A' ' 66' ' ' ARG . 73.7 mm-40 -66.32 -38.65 88.19 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.1 mt -75.26 -52.2 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 0.0 109.09 178.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.464 ' N ' ' O ' ' A' ' 78' ' ' TRP . 59.0 mt -51.25 -53.77 13.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.323 -0.861 . . . . 0.0 109.03 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -69.75 -38.71 76.9 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.27 -0.894 . . . . 0.0 109.334 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.43 -34.36 48.69 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 88.7 mt -86.68 -8.71 57.19 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.445 -1.033 . . . . 0.0 108.587 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 64.29 40.36 6.67 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.758 -0.589 . . . . 0.0 109.901 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -74.61 143.67 79.3 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 108.996 178.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.509 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.4 Cg_endo -70.2 143.3 48.3 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.982 1.788 . . . . 0.0 111.597 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p -60.23 1.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.892 . . . . 0.0 110.162 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.509 ' H ' ' C ' ' A' ' 88' ' ' PRO . 91.4 p -66.43 -22.2 66.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.162 -0.962 . . . . 0.0 110.062 -178.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.4 mt -100.11 106.18 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.927 -1.108 . . . . 0.0 109.346 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.7 p -78.56 -25.33 45.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -0.949 . . . . 0.0 108.714 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -93.88 32.36 1.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' O ' ' C ' ' A' ' 95' ' ' ALA . . . -63.77 -65.5 0.67 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.32 -0.863 . . . . 0.0 109.096 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' ALA . . . -47.33 -52.14 17.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.99 -1.069 . . . . 0.0 108.99 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.479 ' O ' ' OG1' ' A' ' 100' ' ' THR . 8.4 tp -58.03 -44.76 87.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.097 -1.002 . . . . 0.0 109.191 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.3 m -61.78 -39.67 92.5 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.089 -1.007 . . . . 0.0 108.758 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.2 mt -67.44 -45.16 76.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.511 -0.743 . . . . 0.0 109.947 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -68.93 -49.24 59.81 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.139 -0.976 . . . . 0.0 111.219 -179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -55.01 -54.42 43.2 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 120.913 -1.117 . . . . 0.0 109.565 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -63.42 -42.38 98.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.097 -1.002 . . . . 0.0 111.777 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.402 ' CE2' HG23 ' A' ' 63' ' ' VAL . 3.6 t80 -57.13 -42.73 81.47 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.162 -1.586 . . . . 0.0 109.142 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.422 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 84.7 mtp -54.41 -56.21 20.94 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.623 -0.673 . . . . 0.0 112.337 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -71.4 -48.89 46.97 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.28 -1.512 . . . . 0.0 112.392 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -86.29 -52.35 5.69 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -174.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.552 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.0 mp -98.0 12.15 35.2 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.287 -1.508 . . . . 0.0 113.74 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.569 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 55.2 t80 -66.89 -37.15 13.15 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 119.93 -1.731 . . . . 0.0 111.638 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.7 Cg_endo -82.47 -38.75 0.17 Allowed 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.705 1.604 . . . . 0.0 112.532 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.405 ' CD2' HD12 ' A' ' 32' ' ' LEU . 7.7 t80 -58.7 -41.39 86.19 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 178.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -72.02 -49.34 37.69 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.569 -0.707 . . . . 0.0 109.926 179.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.8 OUTLIER -73.82 -45.48 51.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.324 -0.86 . . . . 0.0 110.891 -178.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.43 -47.77 72.15 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.057 -1.027 . . . . 0.0 110.905 -178.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 22.0 mmtp -77.02 -27.33 54.54 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 120.978 -1.076 . . . . 0.0 111.333 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -125.3 -29.27 3.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.9 -1.125 . . . . 0.0 111.536 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 111' ' ' CYS . 61.6 t30 59.45 45.13 14.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.59 -1.319 . . . . 0.0 109.987 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 79.5 mt -67.82 -33.63 75.16 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.301 -0.875 . . . . 0.0 111.211 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 118' ' ' THR . 28.8 t -154.28 -166.98 2.49 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.627 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.547 ' N ' ' OG ' ' A' ' 117' ' ' SER . 77.9 p -128.45 163.36 45.08 Favored Pre-proline 0 N--CA 1.498 1.934 0 O-C-N 121.795 -0.566 . . . . 0.0 109.86 -178.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.413 ' CD ' ' OH ' ' A' ' 107' ' ' TYR . 35.9 Cg_exo -59.7 -40.31 65.71 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 121.763 1.642 . . . . 0.0 112.404 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.08 -37.94 89.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.825 -1.172 . . . . 0.0 109.665 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.479 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -67.0 -44.92 79.13 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.1 tp -66.51 -53.19 37.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.597 -0.69 . . . . 0.0 110.275 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -56.18 -46.55 79.34 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 108.982 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.79 -39.31 88.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.468 -0.77 . . . . 0.0 109.77 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.51 76.48 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.233 -0.917 . . . . 0.0 108.664 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.422 ' CD1' ' SD ' ' A' ' 103' ' ' MET . 16.9 mt -65.01 -49.48 79.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.89 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -62.08 -37.94 86.93 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.44 -32.72 85.15 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.617 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -93.94 -33.51 13.44 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.805 -1.409 . . . . 0.0 110.592 -179.017 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.617 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 54.6 mtp180 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 120.748 -1.22 . . . . 0.0 109.616 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.601 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 45.9 mm-40 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.176 0.512 . . . . 0.0 109.879 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CE1' ' NE ' ' A' ' 14' ' ' ARG . 84.6 t80 -58.75 -52.54 65.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.213 -0.93 . . . . 0.0 109.733 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -61.5 -47.11 87.11 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.272 -0.893 . . . . 0.0 109.889 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.85 -50.42 68.93 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.418 -0.801 . . . . 0.0 110.896 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -69.48 -34.61 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 120.61 -1.306 . . . . 0.0 108.595 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.64 ' NE ' ' CE1' ' A' ' 10' ' ' PHE . 13.1 mmt180 -62.68 -39.95 95.56 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.512 -1.367 . . . . 0.0 107.787 178.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.71 -26.02 55.83 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.7 mt -78.66 -37.59 41.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.536 -0.727 . . . . 0.0 111.835 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.491 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.4 m-85 -79.35 -31.08 42.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.389 -1.445 . . . . 0.0 110.468 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -63.61 -29.81 71.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.882 -1.136 . . . . 0.0 109.639 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.403 ' CG2' HH12 ' A' ' 25' ' ' ARG . 56.9 mt -43.07 -45.47 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 O-C-N 121.571 -0.705 . . . . 0.0 110.248 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.781 HD22 HH11 ' A' ' 25' ' ' ARG . 0.0 OUTLIER 179.98 125.46 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.238 -0.914 . . . . 0.0 108.618 178.029 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -82.21 78.1 8.93 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 111.416 -177.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -98.01 124.23 48.36 Favored Pre-proline 0 N--CA 1.489 1.487 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -36.39 -57.52 0.58 Allowed 'Trans proline' 0 C--N 1.313 -1.295 0 C-N-CA 122.208 1.938 . . . . 0.0 113.22 -178.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -62.78 -42.07 99.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.047 -1.033 . . . . 0.0 110.76 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.781 HH11 HD22 ' A' ' 20' ' ' ASN . 60.7 ttt180 -60.67 -45.13 95.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.809 -1.182 . . . . 0.0 111.678 -178.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -59.89 -51.18 70.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.37 -1.456 . . . . 0.0 108.701 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -54.68 -36.46 64.67 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -59.11 -66.04 0.57 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.277 -0.889 . . . . 0.0 110.221 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.8 mt -55.95 -43.0 77.04 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.495 0.664 . . . . 0.0 109.535 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.9 m-20 -60.36 -50.25 74.34 Favored 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.305 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.426 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 56.8 t0 -66.98 -43.56 82.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.227 -0.921 . . . . 0.0 109.838 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.456 ' O ' ' CG ' ' A' ' 36' ' ' MET . 46.9 tp -54.69 -54.07 46.62 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.336 -0.853 . . . . 0.0 110.198 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.34 -33.64 75.97 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.594 -1.316 . . . . 0.0 108.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.6 t -69.81 -63.19 1.12 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.618 -0.676 . . . . 0.0 111.271 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.467 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -62.01 -32.09 72.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.111 -0.993 . . . . 0.0 110.723 -178.511 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.456 ' CG ' ' O ' ' A' ' 32' ' ' LEU . 62.2 mmm -59.43 -34.92 73.1 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.985 -1.072 . . . . 0.0 109.866 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.59 -40.15 93.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.242 -0.911 . . . . 0.0 110.321 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -58.43 -48.08 81.87 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.465 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.3 OUTLIER -63.71 -21.93 66.65 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.385 -0.822 . . . . 0.0 110.559 -178.35 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.62 7.43 60.26 Favored Glycine 0 N--CA 1.481 1.643 0 N-CA-C 107.837 -2.105 . . . . 0.0 107.837 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 p -117.89 85.2 22.33 Favored Pre-proline 0 N--CA 1.492 1.641 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -93.73 146.72 2.13 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 123.346 2.697 . . . . 0.0 112.154 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.422 HG23 HD11 ' A' ' 43' ' ' ILE . 80.2 mt -79.22 95.59 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 109.535 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.601 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 19.6 m120 -59.37 -28.58 67.0 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -160.64 138.22 9.44 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.434 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -71.69 145.2 89.43 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 120.976 -1.078 . . . . 0.0 108.544 -179.365 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -66.77 131.34 25.51 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.235 1.29 . . . . 0.0 109.215 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.9 mt -97.39 143.31 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 120.903 -1.123 . . . . 0.0 110.126 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 75.1 mtp -138.98 121.92 16.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 67.78 40.56 2.4 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.1 mttm 57.17 24.24 9.54 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.47 0.652 . . . . 0.0 109.459 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.2 m -135.43 153.42 51.79 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.38 -0.825 . . . . 0.0 109.144 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -70.44 146.64 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.055 -1.028 . . . . 0.0 109.328 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.4 tp -79.14 123.8 27.72 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.402 -0.811 . . . . 0.0 110.445 -178.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -65.49 88.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.3 mt -54.42 -24.1 18.56 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 120.995 -1.066 . . . . 0.0 109.552 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.502 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 41.7 t80 -82.29 -56.6 3.81 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 111.735 -178.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.54 -38.49 81.16 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.531 -1.356 . . . . 0.0 109.321 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.6 tp -57.46 -46.49 83.59 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.417 ' CZ ' HD13 ' A' ' 64' ' ' ILE . 46.3 t80 -56.98 -64.58 0.83 Allowed 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.614 ' N ' HD21 ' A' ' 61' ' ' ASN . 1.4 m120 -44.3 -40.16 5.06 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.389 -0.819 . . . . 0.0 111.128 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 66' ' ' ARG . 6.9 mt -72.07 -44.34 63.46 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 118.085 -1.446 . . . . 0.0 107.518 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.41 HG22 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -60.09 -44.49 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.417 HD13 ' CZ ' ' A' ' 60' ' ' TYR . 12.3 mm -67.91 -36.5 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.467 -1.396 . . . . 0.0 107.981 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -20.84 21.39 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.174 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.59 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -93.41 1.5 56.85 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.596 -1.315 . . . . 0.0 109.304 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.89 15.29 75.56 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.014 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.73 2.97 Favored Glycine 0 N--CA 1.498 2.816 0 O-C-N 120.463 -1.61 . . . . 0.0 111.309 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.425 ' N ' ' OE2' ' A' ' 110' ' ' GLU . 19.6 tp -48.45 -38.13 19.05 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.71 -0.876 . . . . 0.0 110.785 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.408 HG22 ' HG ' ' A' ' 117' ' ' SER . 97.0 t -57.95 -41.74 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 120.846 -1.159 . . . . 0.0 110.476 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -58.78 -37.6 76.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.97 . . . . 0.0 109.914 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' LYS . 21.2 t -66.13 -42.5 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 110.643 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.408 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 48.3 mt -69.48 -57.92 7.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 120.828 -1.17 . . . . 0.0 110.548 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -58.01 -41.53 83.33 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.047 -1.033 . . . . 0.0 110.333 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -92.4 -7.98 46.15 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.261 -0.899 . . . . 0.0 110.428 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.7 mttp 58.12 55.69 5.03 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.309 -0.87 . . . . 0.0 110.592 -179.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.1 mt -90.61 12.45 18.86 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.699 -1.25 . . . . 0.0 107.835 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.403 ' CH2' HD11 ' A' ' 69' ' ' LEU . 98.3 m95 -62.31 -41.34 98.46 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mm100 -48.86 -37.71 20.33 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.737 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.59 ' CB ' HH21 ' A' ' 66' ' ' ARG . 93.3 mt-10 -69.62 -40.82 76.35 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -67.49 -53.51 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.6 mt -51.27 -57.65 2.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.299 -0.876 . . . . 0.0 109.266 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -66.83 -37.4 84.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.153 -0.967 . . . . 0.0 109.467 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.91 -37.59 58.21 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.71 -8.71 58.75 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.329 -1.101 . . . . 0.0 108.17 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 69.0 41.16 1.48 Allowed 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.236 0.541 . . . . 0.0 110.844 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -73.4 148.44 88.23 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.196 -0.94 . . . . 0.0 108.789 177.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.29 170.25 18.75 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.301 2.001 . . . . 0.0 112.282 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.5 t -79.55 -1.74 39.16 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.46 -0.775 . . . . 0.0 109.4 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 24.4 m -65.06 -33.97 77.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.504 -0.748 . . . . 0.0 110.652 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.441 HG22 HD12 ' A' ' 91' ' ' ILE . 86.0 mt -92.76 98.89 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 120.637 -1.289 . . . . 0.0 109.263 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.411 ' HG1' ' N ' ' A' ' 93' ' ' SER . 31.9 p -72.21 -30.49 64.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.077 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.411 ' N ' ' HG1' ' A' ' 92' ' ' THR . 9.4 m -97.5 45.19 1.03 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.496 -0.752 . . . . 0.0 109.43 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -59.55 3.34 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.113 -0.992 . . . . 0.0 108.868 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -46.18 -50.55 15.57 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.197 -0.939 . . . . 0.0 109.633 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.49 ' O ' ' OG1' ' A' ' 100' ' ' THR . 7.4 tp -58.19 -43.75 87.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.681 -1.262 . . . . 0.0 109.023 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.1 m -62.5 -40.76 97.77 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.055 -1.028 . . . . 0.0 108.822 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.3 mt -69.3 -42.87 74.87 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.562 -0.711 . . . . 0.0 110.252 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.735 ' NH1' HD22 ' A' ' 129' ' ' ASN . 46.4 ttp180 -69.24 -50.11 50.11 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.155 -0.966 . . . . 0.0 110.859 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -54.31 -54.58 38.36 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.026 -1.046 . . . . 0.0 109.419 -179.015 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -62.86 -41.19 99.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.16 -0.962 . . . . 0.0 111.468 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.45 ' CE1' ' OE1' ' A' ' 110' ' ' GLU . 2.5 t80 -58.16 -43.93 87.65 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 119.826 -1.796 . . . . 0.0 109.153 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp -51.96 -56.52 13.69 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.78 -0.575 . . . . 0.0 112.097 -178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.1 mttm -73.48 -51.08 18.38 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.517 -1.364 . . . . 0.0 112.553 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -85.49 -48.1 9.28 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.534 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.8 mp -97.5 -1.51 43.93 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.23 -1.544 . . . . 0.0 113.433 -176.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.656 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 66.2 t80 -64.15 -36.06 18.06 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 119.865 -1.772 . . . . 0.0 109.709 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 10.6 Cg_exo -66.81 -51.73 0.83 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 C-N-CA 121.801 1.667 . . . . 0.0 111.213 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.426 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 1.3 t80 -58.03 -50.29 73.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.233 -0.917 . . . . 0.0 109.271 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.45 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 85.9 tt0 -65.67 -43.94 87.76 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.296 -0.878 . . . . 0.0 110.843 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.3 -45.31 18.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.983 . . . . 0.0 110.422 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 108' ' ' PRO . 32.0 tt0 -67.65 -51.87 44.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.269 -0.894 . . . . 0.0 111.417 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -75.33 -29.62 60.03 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -0.97 . . . . 0.0 111.961 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -123.33 -28.92 3.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.972 -1.08 . . . . 0.0 111.852 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 30.0 t30 57.86 46.02 17.51 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.742 -1.224 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.86 -31.79 72.94 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.917 -1.114 . . . . 0.0 110.94 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.595 ' OG ' ' N ' ' A' ' 118' ' ' THR . 10.7 t -153.91 -167.01 2.53 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 119.001 -1.08 . . . . 0.0 111.192 -178.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.595 ' N ' ' OG ' ' A' ' 117' ' ' SER . 53.9 p -129.35 155.55 79.86 Favored Pre-proline 0 N--CA 1.5 2.054 0 O-C-N 121.474 -0.766 . . . . 0.0 110.583 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -49.91 -43.19 42.37 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 122.106 1.871 . . . . 0.0 112.42 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.14 88.58 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.789 -1.194 . . . . 0.0 109.371 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.492 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -65.97 -45.61 81.08 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.408 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 44.2 tp -66.54 -53.42 35.04 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 110.415 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -56.03 -45.04 79.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.775 -1.203 . . . . 0.0 109.128 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.27 96.67 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.461 -0.775 . . . . 0.0 110.333 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.31 -35.79 78.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 108.686 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.528 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 24.3 mt -64.77 -48.04 86.14 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 CA-C-O 121.536 0.684 . . . . 0.0 109.189 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -65.71 -36.93 85.02 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.045 -1.034 . . . . 0.0 108.967 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -63.4 -32.88 85.65 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.735 HD22 ' NH1' ' A' ' 99' ' ' ARG . 10.9 p-10 -94.02 -31.52 14.2 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.886 -1.361 . . . . 0.0 110.305 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.623 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 48.3 mtp180 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 120.926 -1.109 . . . . 0.0 109.948 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.438 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 33.5 mt-30 . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.908 0.385 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -55.54 -45.96 77.17 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.927 -1.108 . . . . 0.0 109.0 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -61.32 -41.34 96.84 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.821 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -66.32 -53.22 38.93 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.42 -0.8 . . . . 0.0 111.378 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.0 p -70.04 -35.49 64.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.084 -1.01 . . . . 0.0 110.688 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.531 ' HG2' HH11 ' A' ' 14' ' ' ARG . 1.1 tpt180 -62.18 -36.08 80.78 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 119.761 -1.837 . . . . 0.0 107.864 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -59.32 -32.58 70.2 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.2 mt -63.03 -39.12 93.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.345 -0.847 . . . . 0.0 110.648 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -80.46 -36.31 33.71 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.565 -1.335 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' A' ' 14' ' ' ARG . 76.5 mm-40 -65.23 -30.05 70.9 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.903 -1.123 . . . . 0.0 111.024 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.528 ' CG2' HH12 ' A' ' 25' ' ' ARG . 15.5 mt -38.13 -39.01 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 O-C-N 121.506 -0.746 . . . . 0.0 111.061 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -170.3 163.11 8.75 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.563 -1.336 . . . . 0.0 110.785 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -90.04 67.06 6.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.775 -0.578 . . . . 0.0 110.494 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.408 ' OD1' ' C ' ' A' ' 22' ' ' ASP . 51.7 t0 -111.98 99.46 45.78 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -49.62 -47.62 22.2 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.392 2.061 . . . . 0.0 112.845 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -37.65 80.14 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.035 -1.041 . . . . 0.0 108.951 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.528 HH12 ' CG2' ' A' ' 19' ' ' ILE . 66.0 ttt180 -60.34 -36.82 78.85 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.263 -0.898 . . . . 0.0 109.46 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.57 -50.46 73.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.189 -0.945 . . . . 0.0 109.177 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -53.41 -36.92 62.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 109.288 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.72 -61.72 2.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.51 -0.744 . . . . 0.0 110.926 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.407 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 65.1 mt -53.75 -48.21 69.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.449 -0.782 . . . . 0.0 110.204 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 78.6 m-20 -59.83 -51.73 68.49 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.39 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -65.92 -42.15 90.48 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.966 -1.084 . . . . 0.0 109.794 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 HD13 ' CD2' ' A' ' 109' ' ' TYR . 56.9 tp -57.64 -51.26 70.23 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.006 -1.059 . . . . 0.0 110.28 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -60.21 -34.59 73.86 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 118.441 -1.303 . . . . 0.0 108.01 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.6 m -67.48 -54.03 23.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.819 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CZ ' ' HG2' ' A' ' 112' ' ' GLU . 51.5 t80 -60.3 -39.48 87.1 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.178 -0.952 . . . . 0.0 109.958 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 76.4 mmm -58.72 -42.53 88.94 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.441 -0.787 . . . . 0.0 110.717 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.0 -35.53 81.49 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.892 -1.13 . . . . 0.0 109.726 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -59.0 -53.45 58.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.213 -0.929 . . . . 0.0 109.722 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.458 HH11 ' HB3' ' A' ' 108' ' ' PRO . 25.7 mtp180 -64.53 -18.04 64.47 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.503 -0.748 . . . . 0.0 111.626 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.57 5.09 60.37 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 107.817 -2.113 . . . . 0.0 107.817 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.9 p -115.62 83.74 11.58 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -87.12 146.44 7.63 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.898 2.398 . . . . 0.0 111.286 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.96 99.11 4.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 120.869 -1.144 . . . . 0.0 109.185 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.484 ' CB ' HH21 ' A' ' 45' ' ' ARG . 92.7 m-20 -64.99 -49.84 68.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.148 -0.97 . . . . 0.0 109.108 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.484 HH21 ' CB ' ' A' ' 44' ' ' ASN . 7.7 mtm180 -135.56 137.26 41.84 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.305 -0.872 . . . . 0.0 108.832 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.9 mt -71.9 141.96 84.98 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 120.951 -1.093 . . . . 0.0 109.368 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -71.16 108.16 2.28 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 121.483 1.455 . . . . 0.0 109.785 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.404 HG21 ' N ' ' A' ' 49' ' ' MET . 49.9 mt -76.92 143.22 13.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 110.298 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.404 ' N ' HG21 ' A' ' 48' ' ' ILE . 28.8 mmm -137.55 124.63 21.54 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.09 41.08 8.47 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.6 mttp 60.5 23.03 12.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.982 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.9 m -136.42 153.01 51.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.102 -0.999 . . . . 0.0 109.59 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.1 m -65.94 143.57 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 108.895 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.7 tp -75.12 122.45 23.61 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.076 -1.015 . . . . 0.0 109.554 -179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.04 97.16 0.08 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.423 -0.798 . . . . 0.0 109.022 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.7 mt -58.59 -27.98 65.14 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.3 -0.875 . . . . 0.0 109.138 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -80.27 -62.18 1.76 Allowed 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.863 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -55.51 -37.14 67.48 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.692 -1.255 . . . . 0.0 110.075 -178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.4 tp -63.11 -45.2 93.15 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.426 ' O ' ' C ' ' A' ' 61' ' ' ASN . 63.4 t80 -62.16 -66.57 0.52 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 60' ' ' TYR . 50.7 t-20 -42.54 -37.7 1.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.612 -0.68 . . . . 0.0 109.355 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.575 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 11.5 mt -70.36 -48.58 55.67 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.417 HG21 ' CE2' ' A' ' 102' ' ' TYR . 30.4 t -55.58 -42.17 67.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.256 -0.903 . . . . 0.0 110.051 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.45 HD13 HG22 ' A' ' 64' ' ' ILE . 10.9 mm -71.16 -33.59 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 120.795 -1.19 . . . . 0.0 107.888 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.53 -19.38 24.62 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.738 -0.785 . . . . 0.0 109.56 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.581 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.4 mmt-85 -96.79 -3.24 42.64 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.736 -1.228 . . . . 0.0 108.273 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 13.16 71.78 Favored Glycine 0 N--CA 1.491 2.341 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.059 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.07 131.45 2.45 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.297 -1.707 . . . . 0.0 111.714 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.6 tp -50.2 -41.21 49.19 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.589 -0.947 . . . . 0.0 109.998 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 80.0 t -61.49 -43.15 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.148 -0.97 . . . . 0.0 109.732 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -55.24 -38.8 68.97 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.971 -1.08 . . . . 0.0 108.862 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.637 ' O ' ' N ' ' A' ' 76' ' ' LYS . 47.0 t -64.22 -42.55 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.653 -0.654 . . . . 0.0 109.587 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.483 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 95.1 mt -65.38 -59.06 4.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.68 0 O-C-N 121.052 -1.03 . . . . 0.0 110.679 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -58.26 -40.58 82.21 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.104 -0.998 . . . . 0.0 110.4 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.7 mmtt -93.14 -12.22 30.94 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.211 -0.931 . . . . 0.0 110.855 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.637 ' N ' ' O ' ' A' ' 72' ' ' VAL . 15.1 mtmt 59.67 62.68 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.252 -0.905 . . . . 0.0 110.102 -178.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.1 14.33 24.21 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.094 -1.004 . . . . 0.0 108.627 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' GLN . 81.8 m95 -63.44 -39.22 93.91 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.291 -0.881 . . . . 0.0 109.341 179.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.4 mm-40 -49.31 -38.29 27.12 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.651 -1.281 . . . . 0.0 108.28 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.581 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.9 mm-40 -70.53 -42.2 71.54 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.402 HG12 ' NH2' ' A' ' 66' ' ' ARG . 3.7 mt -67.34 -54.73 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' A' ' 78' ' ' TRP . 58.5 mt -53.37 -53.6 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.575 -0.703 . . . . 0.0 109.973 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -65.81 -41.31 92.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.014 -1.054 . . . . 0.0 109.627 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.48 -32.72 46.08 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.2 mt -88.93 -8.48 54.1 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.379 -1.071 . . . . 0.0 108.991 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 65.32 40.8 4.64 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 109.935 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.2 mt -73.42 119.21 74.67 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.341 -0.85 . . . . 0.0 109.385 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' A' ' 90' ' ' SER . 52.0 Cg_exo -48.44 141.96 18.36 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 121.719 1.613 . . . . 0.0 112.229 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.8 p -59.58 -1.61 0.26 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.286 -0.884 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.499 ' H ' ' C ' ' A' ' 88' ' ' PRO . 83.8 p -66.45 -22.9 66.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.168 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -97.78 107.48 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 120.803 -1.185 . . . . 0.0 109.46 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.5 p -78.48 -28.12 46.39 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.8 m -88.67 29.58 0.99 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.675 -0.64 . . . . 0.0 109.358 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.67 -66.64 0.46 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -50.8 -53.5 31.45 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.457 -0.777 . . . . 0.0 109.501 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.8 tp -57.36 -45.43 84.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 109.049 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 49.6 m -60.2 -40.34 89.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.155 -0.966 . . . . 0.0 108.744 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.9 mt -70.8 -47.16 60.94 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.493 -0.754 . . . . 0.0 110.009 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.507 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 39.8 ttm180 -62.89 -51.87 65.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.003 -1.061 . . . . 0.0 111.3 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.1 m -56.7 -54.84 41.53 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.05 -1.031 . . . . 0.0 110.531 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.56 -41.87 99.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.359 -0.838 . . . . 0.0 111.264 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.417 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.5 t80 -57.88 -40.53 80.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.576 -1.328 . . . . 0.0 109.521 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.3 ttm -52.82 -55.32 23.88 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.415 -0.803 . . . . 0.0 110.999 -178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -73.36 -53.37 10.93 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.874 -1.141 . . . . 0.0 112.882 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -84.6 -46.99 10.99 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -174.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.3 mp -97.45 -8.7 28.74 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.148 -1.595 . . . . 0.0 114.23 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.655 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 14.3 t80 -60.49 -38.37 56.65 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 119.725 -1.859 . . . . 0.0 109.099 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 52.5 Cg_exo -58.7 -59.74 0.44 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.578 2.186 . . . . 0.0 112.81 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.413 ' CD2' HD13 ' A' ' 32' ' ' LEU . 8.8 t80 -59.17 -40.86 86.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.614 -0.679 . . . . 0.0 109.518 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -69.99 -46.03 66.05 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.457 -0.777 . . . . 0.0 110.4 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ASN . 17.0 t -76.99 -45.62 26.72 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.234 -0.916 . . . . 0.0 109.912 -179.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HG2' ' CZ ' ' A' ' 35' ' ' PHE . 51.3 tp10 -66.3 -49.81 65.78 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.245 -0.909 . . . . 0.0 111.266 -178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 28.9 mmtm -74.2 -29.34 61.7 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.971 -1.081 . . . . 0.0 111.545 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -125.04 -28.11 3.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.897 -1.127 . . . . 0.0 111.703 -177.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 111' ' ' CYS . 55.1 t30 56.28 47.5 19.08 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.666 -1.271 . . . . 0.0 110.619 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.02 -30.06 68.37 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.178 -0.951 . . . . 0.0 110.846 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 8.1 t -154.16 -165.94 2.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.017 -1.052 . . . . 0.0 111.092 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 70.6 p -130.48 155.49 81.01 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.562 -0.711 . . . . 0.0 109.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.54 -40.09 64.08 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.862 1.708 . . . . 0.0 112.526 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.99 89.24 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.836 -1.165 . . . . 0.0 109.384 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -66.36 -42.71 87.66 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.483 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 16.3 tp -68.75 -51.45 41.11 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.557 -0.714 . . . . 0.0 110.212 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -58.94 -45.08 91.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.936 -1.103 . . . . 0.0 109.365 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.66 -42.46 98.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.131 -0.981 . . . . 0.0 110.327 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.91 -32.21 72.53 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 122.094 0.95 . . . . 0.0 108.728 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.457 HG22 HD12 ' A' ' 126' ' ' ILE . 4.9 mt -64.53 -51.4 68.27 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -63.72 -38.77 92.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 109.381 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -59.9 -34.02 81.13 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.676 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -93.46 -35.49 12.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.138 -1.213 . . . . 0.0 110.117 -179.329 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.676 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.9 mtp180 . . . . . 0 N--CA 1.492 1.665 0 O-C-N 120.933 -1.104 . . . . 0.0 109.735 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 38.3 mt-30 . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -49.73 -50.52 43.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -62.58 -37.2 85.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.108 -0.995 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.43 -52.64 51.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.979 -1.075 . . . . 0.0 111.969 -178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.7 p -68.87 -33.85 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 120.824 -1.173 . . . . 0.0 110.567 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -67.32 -36.4 81.4 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.053 -1.655 . . . . 0.0 108.702 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.408 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 12.3 mm-40 -59.16 -28.98 67.1 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mt -67.66 -42.32 82.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.398 -0.814 . . . . 0.0 111.634 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -76.32 -33.75 59.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.37 -1.456 . . . . 0.0 109.634 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.496 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.7 mm-40 -62.62 -31.56 72.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.025 -1.047 . . . . 0.0 110.243 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.496 ' C ' ' O ' ' A' ' 18' ' ' GLU . 32.2 mt -36.98 -40.69 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.737 -0.602 . . . . 0.0 110.312 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.24 161.37 5.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.857 -1.152 . . . . 0.0 110.256 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -92.13 73.78 5.47 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -110.93 137.51 20.88 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -71.78 -62.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.251 1.967 . . . . 0.0 112.643 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -58.0 -33.64 69.15 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.056 -1.027 . . . . 0.0 109.276 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.426 HH22 HG22 ' A' ' 19' ' ' ILE . 58.0 ttt180 -61.87 -41.08 97.44 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.862 -1.149 . . . . 0.0 109.994 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -59.8 -59.57 5.22 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.016 -1.052 . . . . 0.0 109.883 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 7.8 pt-20 -53.15 -29.85 33.72 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.551 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -64.55 -61.98 1.87 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.06 . . . . 0.0 109.996 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.489 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 55.1 mt -53.63 -45.88 70.28 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.349 -0.844 . . . . 0.0 109.557 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -65.56 -49.52 68.57 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.519 -179.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.599 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 57.2 t0 -64.87 -39.85 94.19 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.189 -0.945 . . . . 0.0 109.001 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.7 tp -60.76 -49.7 76.44 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.155 -1.018 . . . . 0.0 109.058 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.489 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.7 m-85 -61.55 -35.3 77.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.6 t -68.08 -54.49 17.82 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.523 -0.735 . . . . 0.0 109.576 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.91 -40.85 85.76 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.227 -0.92 . . . . 0.0 109.722 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.418 ' CE ' ' O ' ' A' ' 41' ' ' THR . 75.2 mmm -60.36 -38.15 82.94 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.577 -0.702 . . . . 0.0 110.013 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -61.85 -39.19 90.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.125 -0.985 . . . . 0.0 109.375 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -64.43 -50.53 67.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.923 . . . . 0.0 111.292 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.416 ' NE ' ' HB2' ' A' ' 108' ' ' PRO . 0.9 OUTLIER -63.69 -18.84 64.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.931 -1.106 . . . . 0.0 111.421 -177.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 4.18 61.36 Favored Glycine 0 N--CA 1.482 1.736 0 N-CA-C 107.746 -2.142 . . . . 0.0 107.746 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.418 ' O ' ' CE ' ' A' ' 36' ' ' MET . 19.4 p -114.62 83.38 8.85 Favored Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.37 151.38 13.56 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.729 2.286 . . . . 0.0 111.235 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.439 HD11 HG23 ' A' ' 43' ' ' ILE . 18.3 mt -89.11 103.46 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 110.724 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 4.0 m120 -63.54 -74.51 0.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -116.56 135.26 53.96 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.6 mt -69.15 144.43 95.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.224 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -65.82 134.88 39.2 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 121.2 1.267 . . . . 0.0 108.974 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.1 mt -102.37 145.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.024 -1.048 . . . . 0.0 110.242 -178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.478 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 75.6 mtp -142.73 119.3 11.04 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.478 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 71.8 39.13 0.88 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.4 mttm 59.77 24.27 13.21 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.242 0.544 . . . . 0.0 109.79 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.5 p -138.8 159.42 42.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.376 -0.827 . . . . 0.0 109.267 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 148.19 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.001 -1.062 . . . . 0.0 109.738 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 63.6 tp -76.17 121.23 22.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.508 -0.745 . . . . 0.0 109.668 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.403 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.8 m-20 -65.04 93.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.378 -0.826 . . . . 0.0 109.162 -179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.9 mt -56.15 -25.22 45.52 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.287 -0.883 . . . . 0.0 109.341 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -81.32 -58.74 2.91 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.2 -0.938 . . . . 0.0 111.759 -179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.37 -36.81 71.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.417 -1.427 . . . . 0.0 109.257 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.63 -47.48 85.22 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.452 ' O ' ' C ' ' A' ' 61' ' ' ASN . 56.2 t80 -58.81 -70.09 0.16 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 60' ' ' TYR . 63.2 t30 -40.48 -39.31 0.99 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.443 -0.786 . . . . 0.0 109.708 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.6 -50.73 56.83 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.411 HG22 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -57.01 -42.41 79.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.696 -0.628 . . . . 0.0 110.256 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.419 HG22 HD13 ' A' ' 64' ' ' ILE . 5.2 mm -70.15 -29.03 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.21 -29.49 61.03 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.547 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.1 mmt180 -91.61 -4.41 55.31 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.612 -1.305 . . . . 0.0 108.78 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.66 19.63 59.61 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.332 177.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.42 130.31 2.47 Favored Glycine 0 N--CA 1.498 2.811 0 O-C-N 120.28 -1.718 . . . . 0.0 111.475 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.7 tp -50.44 -39.76 48.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.584 -0.951 . . . . 0.0 110.464 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.02 -43.36 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.006 -1.059 . . . . 0.0 109.691 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -57.68 -39.38 77.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.863 -1.148 . . . . 0.0 109.448 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.6 t -62.38 -42.24 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.365 -0.834 . . . . 0.0 109.516 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.8 mt -66.41 -55.66 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 120.851 -1.156 . . . . 0.0 110.692 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -57.17 -42.0 80.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.02 -1.05 . . . . 0.0 110.351 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -94.58 -8.74 37.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.254 -0.904 . . . . 0.0 110.596 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.618 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.9 mttp 57.3 59.11 3.5 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.291 -0.881 . . . . 0.0 109.513 -177.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -88.29 12.89 12.8 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.011 -1.076 . . . . 0.0 108.77 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.502 ' O ' ' N ' ' A' ' 82' ' ' ILE . 71.3 m95 -63.24 -41.04 99.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.16 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' TRP . 15.5 mm100 -49.37 -38.7 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.292 -1.505 . . . . 0.0 108.53 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.671 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.7 mm-40 -71.32 -45.87 61.98 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 108.896 178.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -64.69 -51.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.502 ' N ' ' O ' ' A' ' 78' ' ' TRP . 77.9 mt -52.35 -54.75 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -66.64 -40.93 88.92 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.138 -0.976 . . . . 0.0 109.555 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.44 -32.29 37.66 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.4 mt -89.84 -7.88 53.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.402 -1.058 . . . . 0.0 108.801 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 64.66 42.06 4.94 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.604 -0.685 . . . . 0.0 110.618 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.5 mt -74.42 142.54 78.23 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.081 -1.012 . . . . 0.0 109.224 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.601 ' C ' ' H ' ' A' ' 90' ' ' SER . 51.7 Cg_endo -72.13 142.16 37.52 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.158 1.906 . . . . 0.0 112.163 179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.1 t -56.49 0.99 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 109.761 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 88' ' ' PRO . 19.4 m -65.8 -31.35 72.28 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.107 -0.995 . . . . 0.0 109.838 -178.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.421 HG21 HD13 ' A' ' 91' ' ' ILE . 83.2 mt -93.93 98.26 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 120.822 -1.174 . . . . 0.0 109.486 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.9 p -69.84 -27.94 65.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 108.735 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.9 m -91.23 32.67 1.02 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.519 -0.738 . . . . 0.0 109.164 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.414 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -61.37 -65.52 0.68 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.09 -1.006 . . . . 0.0 108.727 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.77 -52.05 34.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 109.216 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.53 -43.51 89.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.861 -1.149 . . . . 0.0 109.055 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.6 m -60.56 -39.9 89.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.058 -1.026 . . . . 0.0 108.642 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mt -70.2 -46.72 63.99 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.594 -0.691 . . . . 0.0 110.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.497 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 36.9 ttm180 -66.63 -50.92 61.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.066 . . . . 0.0 111.004 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.1 m -55.88 -50.99 69.13 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.967 -1.093 . . . . 0.0 109.026 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -64.31 -43.67 93.99 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.093 -1.005 . . . . 0.0 111.503 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.411 ' CE2' HG22 ' A' ' 63' ' ' VAL . 3.3 t80 -58.75 -41.01 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.274 -1.516 . . . . 0.0 108.859 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.61 ' SD ' ' CD2' ' A' ' 122' ' ' LEU . 42.9 mmm -51.97 -59.49 4.28 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.677 -0.639 . . . . 0.0 111.357 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.663 ' HZ1' ' CB ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -73.62 -50.38 21.37 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.543 -1.348 . . . . 0.0 113.196 -177.372 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 105' ' ' TYR . 57.6 m-85 -82.0 -47.0 13.19 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -174.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.459 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 9.3 mp -104.28 6.19 35.2 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.394 -1.441 . . . . 0.0 114.044 -176.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.511 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 48.1 t80 -65.05 -40.29 44.56 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 119.892 -1.755 . . . . 0.0 111.475 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.499 ' O ' ' N ' ' A' ' 112' ' ' GLU . 83.5 Cg_endo -77.79 -40.98 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 121.687 1.591 . . . . 0.0 113.317 -179.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.59 -43.52 89.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.884 -1.135 . . . . 0.0 108.109 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -68.27 -54.61 16.36 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.517 -0.739 . . . . 0.0 109.932 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' A' ' 115' ' ' ASN . 91.8 m -70.62 -43.15 69.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.866 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.0 tp10 -67.09 -49.5 64.82 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.715 -1.24 . . . . 0.0 110.83 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -76.18 -27.28 56.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.044 -1.035 . . . . 0.0 111.036 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -125.12 -27.3 3.55 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.974 -1.079 . . . . 0.0 111.954 -177.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.568 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.4 t30 58.72 45.23 16.05 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.523 -1.361 . . . . 0.0 110.376 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.4 mt -67.82 -32.0 72.25 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.037 -1.04 . . . . 0.0 110.871 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.494 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 26.0 t -153.23 -167.71 2.8 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 119.009 -1.076 . . . . 0.0 111.292 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 81.2 p -124.5 161.61 47.14 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.605 -0.684 . . . . 0.0 110.137 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.507 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 23.3 Cg_exo -59.83 -40.97 58.53 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.602 1.535 . . . . 0.0 112.36 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.77 -37.11 86.15 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.143 -0.973 . . . . 0.0 109.871 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.494 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.69 -46.19 73.01 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.61 ' CD2' ' SD ' ' A' ' 103' ' ' MET . 11.4 tp -66.47 -52.08 49.96 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.485 -0.759 . . . . 0.0 109.879 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.25 -45.84 87.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.129 -0.982 . . . . 0.0 109.629 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.41 87.78 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.25 -0.906 . . . . 0.0 109.873 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.33 -33.33 74.11 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.231 -0.918 . . . . 0.0 108.907 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.402 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 8.0 mt -65.44 -48.96 81.05 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -64.0 -38.72 92.1 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.446 -0.784 . . . . 0.0 109.138 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.5 -34.08 84.17 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -95.14 -35.19 11.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.122 -1.222 . . . . 0.0 110.598 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 53.7 mtp180 . . . . . 0 N--CA 1.494 1.735 0 O-C-N 120.75 -1.218 . . . . 0.0 109.69 178.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.0 mp0 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.182 0.515 . . . . 0.0 109.851 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.31 -50.9 68.39 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.121 -0.987 . . . . 0.0 109.811 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -62.03 -45.08 95.17 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.09 -1.006 . . . . 0.0 109.66 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -63.71 -47.84 79.52 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.378 -0.826 . . . . 0.0 110.278 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 m -72.78 -36.46 52.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 O-C-N 120.644 -1.285 . . . . 0.0 108.567 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -40.16 75.85 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.492 -1.38 . . . . 0.0 107.761 178.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.401 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.1 OUTLIER -58.79 -30.47 67.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.431 -0.908 . . . . 0.0 108.607 178.247 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.1 mt -71.72 -39.18 70.31 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.415 -0.803 . . . . 0.0 111.661 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.499 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.4 m-85 -76.47 -32.83 58.61 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.402 -1.436 . . . . 0.0 110.29 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.467 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -66.52 -25.85 66.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.899 -1.126 . . . . 0.0 110.386 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.467 ' C ' ' O ' ' A' ' 18' ' ' GLU . 30.3 mt -38.96 -39.72 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 O-C-N 121.605 -0.684 . . . . 0.0 110.397 -179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.2 m120 -171.33 161.84 6.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.739 -1.226 . . . . 0.0 110.315 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -90.5 65.16 6.02 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.47 0.653 . . . . 0.0 109.3 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -111.9 103.22 55.04 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.502 -0.749 . . . . 0.0 109.136 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -47.83 -43.47 29.2 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.015 1.81 . . . . 0.0 111.957 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -61.62 -38.48 87.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.19 -0.944 . . . . 0.0 108.535 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.641 ' CG ' HH11 ' A' ' 25' ' ' ARG . 0.5 OUTLIER -60.36 -44.53 95.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.5 -0.75 . . . . 0.0 109.389 179.89 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.3 -53.54 53.59 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 0.0 109.77 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -52.74 -39.05 61.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.432 -0.793 . . . . 0.0 109.175 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -61.12 -63.01 1.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.325 -0.859 . . . . 0.0 109.858 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.401 HD11 ' NH1' ' A' ' 25' ' ' ARG . 43.7 mt -56.2 -44.72 79.75 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.585 -0.697 . . . . 0.0 109.521 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 79.3 m-20 -61.93 -46.53 88.94 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.704 -0.798 . . . . 0.0 109.121 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -66.59 -42.91 86.21 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.7 tp -61.07 -49.3 77.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 0.0 110.658 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -60.43 -36.44 78.19 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.284 -1.51 . . . . 0.0 107.528 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.3 t -69.93 -53.27 18.64 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.508 -0.745 . . . . 0.0 109.478 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -58.73 -42.38 88.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 111.17 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.446 ' CE ' ' O ' ' A' ' 41' ' ' THR . 63.4 mmm -56.49 -38.2 71.41 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.142 -0.974 . . . . 0.0 110.915 -178.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -55.68 -40.18 71.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.765 -1.209 . . . . 0.0 108.499 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -64.91 -39.54 93.67 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.884 0.85 . . . . 0.0 108.739 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -64.31 -30.52 71.57 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.522 -0.736 . . . . 0.0 109.265 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.26 -0.83 60.3 Favored Glycine 0 N--CA 1.485 1.948 0 N-CA-C 108.152 -1.979 . . . . 0.0 108.152 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.446 ' O ' ' CE ' ' A' ' 36' ' ' MET . 44.9 p -120.27 84.37 34.44 Favored Pre-proline 0 N--CA 1.488 1.445 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.76 141.93 11.1 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.439 2.093 . . . . 0.0 110.915 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.4 mt -78.8 101.23 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 120.928 -1.107 . . . . 0.0 110.159 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.494 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 3.1 m120 -82.91 -4.09 57.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.652 HH21 ' HH ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -170.4 124.45 0.71 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.583 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 2.3 mt -73.09 147.56 88.3 Favored Pre-proline 0 C--N 1.291 -1.971 0 O-C-N 121.412 -0.805 . . . . 0.0 109.243 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -73.78 133.45 18.57 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.526 1.484 . . . . 0.0 108.999 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.406 HG23 HD11 ' A' ' 48' ' ' ILE . 42.2 mt -101.0 142.51 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.777 -1.202 . . . . 0.0 110.509 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.403 ' N ' HG21 ' A' ' 48' ' ' ILE . 79.0 mtp -135.07 121.69 20.72 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.48 41.42 3.2 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 56.94 22.84 7.58 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.369 0.604 . . . . 0.0 109.681 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -132.79 148.44 52.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.399 -0.813 . . . . 0.0 109.14 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 10.2 m -67.0 145.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.895 -1.128 . . . . 0.0 108.955 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.9 tp -77.11 122.57 25.17 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.307 -0.871 . . . . 0.0 109.795 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -65.84 90.96 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.525 -0.735 . . . . 0.0 109.565 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.3 -24.33 28.08 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 120.877 -1.139 . . . . 0.0 109.438 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.592 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 43.6 t80 -77.98 -59.35 2.82 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.227 -0.92 . . . . 0.0 111.654 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -60.22 -38.36 83.15 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.834 -1.166 . . . . 0.0 110.615 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.1 tp -58.5 -45.03 89.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 178.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.451 ' O ' ' N ' ' A' ' 63' ' ' VAL . 43.7 t80 -57.04 -68.43 0.23 Allowed 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.645 ' N ' HD21 ' A' ' 61' ' ' ASN . 1.2 m120 -39.91 -42.21 1.3 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.613 -0.679 . . . . 0.0 111.142 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.609 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.7 mt -69.47 -44.31 71.44 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.116 -1.433 . . . . 0.0 107.314 179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.451 ' N ' ' O ' ' A' ' 60' ' ' TYR . 34.8 t -58.43 -44.04 87.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 121.261 -0.9 . . . . 0.0 110.288 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.431 ' CD1' ' CE2' ' A' ' 60' ' ' TYR . 1.2 mm -69.42 -34.11 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.386 -1.446 . . . . 0.0 107.986 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.11 28.02 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 120.096 -0.641 . . . . 0.0 109.562 -178.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.61 HH21 ' CB ' ' A' ' 80' ' ' GLU . 7.5 mmt-85 -92.95 -4.39 52.81 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.678 -1.264 . . . . 0.0 108.898 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 19.05 62.63 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.058 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.23 128.17 2.19 Favored Glycine 0 N--CA 1.5 2.942 0 O-C-N 120.342 -1.681 . . . . 0.0 111.815 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.1 tp -48.93 -39.34 25.87 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.601 -0.941 . . . . 0.0 109.723 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 92.8 t -58.82 -43.11 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 109.805 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -56.01 -40.78 73.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.0 109.208 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 48.0 t -60.97 -43.95 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.392 -0.818 . . . . 0.0 109.216 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 88.4 mt -66.57 -56.36 14.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 O-C-N 121.043 -1.036 . . . . 0.0 110.572 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.75 -42.83 79.98 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.991 -1.068 . . . . 0.0 110.322 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -93.28 -8.97 40.63 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.089 -1.007 . . . . 0.0 110.223 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 24.3 mtmm 57.93 60.71 2.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 0.0 109.387 -178.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.0 mt -91.2 14.76 13.39 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.4 ' O ' ' C ' ' A' ' 79' ' ' GLN . 83.0 m95 -63.73 -39.79 95.17 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.389 -0.82 . . . . 0.0 109.132 179.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 78' ' ' TRP . 77.6 mm-40 -50.49 -39.09 47.45 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.456 -1.403 . . . . 0.0 108.252 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.61 ' CB ' HH21 ' A' ' 66' ' ' ARG . 97.6 mt-10 -69.62 -43.14 73.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.45 -51.96 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 85.6 mt -52.36 -51.59 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -0.884 . . . . 0.0 108.866 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.11 -41.63 85.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.198 -0.939 . . . . 0.0 109.688 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.05 -31.53 40.55 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.3 mt -89.38 -8.83 52.31 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.477 -1.014 . . . . 0.0 109.004 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 61.49 40.4 13.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -73.46 141.15 79.7 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.576 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.8 Cg_endo -67.48 138.37 45.81 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 121.884 1.723 . . . . 0.0 112.155 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.7 t -56.1 -0.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.297 -0.877 . . . . 0.0 110.035 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.576 ' H ' ' C ' ' A' ' 88' ' ' PRO . 16.0 m -64.87 -30.82 71.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 109.718 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.409 HG23 ' N ' ' A' ' 94' ' ' ALA . 68.7 mt -93.22 101.32 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.923 -1.111 . . . . 0.0 109.406 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -72.79 -28.02 62.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.076 -1.015 . . . . 0.0 108.662 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.4 m -89.56 30.05 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.409 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -60.06 -65.35 0.69 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.59 -52.62 29.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.451 -0.78 . . . . 0.0 109.607 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.79 -43.99 90.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.872 -1.142 . . . . 0.0 109.304 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 m -60.17 -38.63 83.79 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.097 -1.002 . . . . 0.0 108.597 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.8 mt -70.8 -46.5 62.72 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.614 -0.678 . . . . 0.0 109.85 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.531 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.0 ttm180 -65.87 -51.35 59.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 111.179 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.408 ' H ' ' HG1' ' A' ' 100' ' ' THR . 4.5 m -55.94 -53.39 57.39 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 110.108 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -63.09 -41.14 99.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.171 -0.956 . . . . 0.0 111.273 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.401 ' CE2' HG22 ' A' ' 63' ' ' VAL . 2.8 t80 -57.03 -41.44 78.62 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.112 -1.617 . . . . 0.0 109.447 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.496 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.0 OUTLIER -55.94 -55.54 31.4 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.387 -0.82 . . . . 0.0 112.157 -178.612 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -70.94 -53.27 15.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 120.84 -1.163 . . . . 0.0 112.702 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.652 ' HH ' HH21 ' A' ' 45' ' ' ARG . 55.7 m-85 -84.31 -44.6 13.67 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -175.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 10.1 mp -102.96 6.4 38.89 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.36 -1.463 . . . . 0.0 113.913 -176.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.62 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 49.0 t80 -62.42 -42.79 82.14 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 119.855 -1.778 . . . . 0.0 111.625 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 112' ' ' GLU . 95.4 Cg_endo -76.96 -41.87 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 121.473 1.448 . . . . 0.0 112.823 -178.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -57.32 -38.97 74.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.82 -1.175 . . . . 0.0 107.981 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.491 ' O ' ' OE1' ' A' ' 110' ' ' GLU . 4.7 tp10 -73.5 -54.8 7.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.608 -0.682 . . . . 0.0 110.282 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.62 ' SG ' ' CE1' ' A' ' 107' ' ' TYR . 98.1 m -73.02 -41.42 64.26 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.318 -0.864 . . . . 0.0 111.16 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.64 -44.8 80.99 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.706 -1.246 . . . . 0.0 110.587 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -74.66 -33.63 62.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.195 -0.941 . . . . 0.0 111.253 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -125.18 -24.37 4.01 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.938 -1.101 . . . . 0.0 111.773 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 111' ' ' CYS . 17.3 t-20 57.01 44.94 21.97 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.631 -1.293 . . . . 0.0 110.23 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.5 -29.62 69.09 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.089 -1.007 . . . . 0.0 110.828 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.492 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 46.5 t -152.66 -169.0 3.21 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.355 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.416 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.4 p -128.84 166.79 22.44 Favored Pre-proline 0 N--CA 1.498 1.974 0 O-C-N 121.593 -0.692 . . . . 0.0 109.61 -178.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -62.88 -40.4 35.54 Favored 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 121.382 1.388 . . . . 0.0 111.908 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.53 87.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.064 -1.023 . . . . 0.0 109.306 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.492 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.4 mt-10 -66.46 -45.63 79.08 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 178.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.414 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 29.3 tp -66.17 -51.03 61.73 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.352 -0.842 . . . . 0.0 109.972 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -57.26 -46.99 82.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.081 -1.012 . . . . 0.0 109.647 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.498 ' O ' ' OD1' ' A' ' 127' ' ' ASP . . . -61.1 -41.02 95.91 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.299 -0.876 . . . . 0.0 110.082 -179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.63 -34.36 75.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 108.417 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.496 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 10.5 mt -63.94 -49.99 79.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.677 ' OD1' ' N ' ' A' ' 128' ' ' GLY . 18.9 p30 -65.75 -32.58 74.21 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 118.863 -1.135 . . . . 0.0 108.588 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.677 ' N ' ' OD1' ' A' ' 127' ' ' ASP . . . -65.61 -30.23 76.92 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.645 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.69 -35.99 14.6 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.004 -1.291 . . . . 0.0 110.741 -179.082 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.6 mtm180 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 120.783 -1.198 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.549 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 38.9 mt-30 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -48.24 -47.27 35.93 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.476 -0.765 . . . . 0.0 109.606 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -62.14 -41.85 98.67 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.162 -0.961 . . . . 0.0 108.687 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.78 -52.95 38.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.683 -0.635 . . . . 0.0 111.454 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -37.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.989 -1.069 . . . . 0.0 109.959 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 tpp180 -60.19 -39.5 86.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.083 -1.636 . . . . 0.0 108.214 178.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -58.3 -30.71 66.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mt -68.08 -39.46 82.92 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.457 -0.777 . . . . 0.0 111.529 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.49 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 90.8 m-85 -77.52 -37.67 50.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.357 -1.464 . . . . 0.0 110.289 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.488 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.1 -27.82 69.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.119 -0.988 . . . . 0.0 111.132 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.488 ' C ' ' O ' ' A' ' 18' ' ' GLU . 16.5 mt -36.1 -40.18 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.592 -0.693 . . . . 0.0 110.578 -178.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.566 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.69 167.74 5.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.836 -1.165 . . . . 0.0 110.356 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 53.6 p30 -90.53 65.39 6.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.575 -0.703 . . . . 0.0 110.707 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.89 136.01 19.6 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.955 . . . . 0.0 108.46 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.503 ' O ' ' OE1' ' A' ' 27' ' ' GLU . 67.4 Cg_endo -75.72 -62.61 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.049 1.833 . . . . 0.0 112.656 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 23' ' ' PRO . 22.8 tptp -55.02 -36.82 65.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.416 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.54 HH22 ' CG ' ' A' ' 55' ' ' ASP . 57.9 ttt180 -57.31 -38.42 73.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.221 -0.924 . . . . 0.0 109.765 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -60.12 -58.48 8.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.963 . . . . 0.0 109.763 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.503 ' OE1' ' O ' ' A' ' 23' ' ' PRO . 44.2 mp0 -53.4 -33.65 54.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.321 -0.862 . . . . 0.0 109.995 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -60.96 -63.19 1.38 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.155 -0.965 . . . . 0.0 110.896 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.468 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 28.1 mt -56.17 -45.44 79.72 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.037 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.49 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 38.4 m-20 -62.41 -46.21 89.62 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.599 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.405 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 43.3 t0 -66.95 -44.39 80.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.223 -0.923 . . . . 0.0 109.782 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.2 tp -56.51 -47.88 78.41 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 110.267 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.468 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.3 m-85 -61.23 -34.74 75.6 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.311 -1.356 . . . . 0.0 108.385 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 m -69.25 -55.13 11.43 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.274 -0.891 . . . . 0.0 110.457 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.408 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 43.0 t80 -60.36 -37.2 79.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.869 . . . . 0.0 110.921 -179.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.5 mmm -59.44 -37.61 78.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.17 -0.956 . . . . 0.0 110.867 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -62.93 -39.76 95.56 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.962 -1.086 . . . . 0.0 110.82 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -63.39 -36.99 85.53 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.645 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -65.03 -29.04 69.91 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.386 -179.286 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.71 -1.76 63.97 Favored Glycine 0 C--N 1.295 -1.717 0 N-CA-C 107.44 -2.264 . . . . 0.0 107.44 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.4 p -116.93 84.02 15.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -86.59 143.18 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.684 2.256 . . . . 0.0 110.575 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.549 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 20.3 mt -78.73 99.44 3.09 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 120.866 -1.146 . . . . 0.0 109.389 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.433 ' HB3' HH12 ' A' ' 45' ' ' ARG . 89.7 m-20 -67.59 -38.11 83.55 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 178.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.613 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -144.28 130.56 19.72 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 178.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.3 mt -71.46 147.61 92.72 Favored Pre-proline 0 C--N 1.298 -1.647 0 O-C-N 121.287 -0.883 . . . . 0.0 109.504 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.41 138.69 33.25 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 121.685 1.59 . . . . 0.0 109.429 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 41.3 mt -104.41 143.14 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.044 -1.035 . . . . 0.0 110.379 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.7 mmm -135.35 127.3 29.56 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.58 42.47 17.29 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.2 mttt 59.72 25.62 14.62 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.415 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.5 p -138.35 154.71 48.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.1 -1.0 . . . . 0.0 109.794 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.7 m -67.16 144.24 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 120.939 -1.101 . . . . 0.0 109.263 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 60.1 tp -77.59 123.95 27.29 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.533 -0.73 . . . . 0.0 109.848 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.54 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.8 m-20 -66.28 90.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.339 -0.851 . . . . 0.0 109.437 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.95 -23.03 11.68 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.053 -1.029 . . . . 0.0 109.174 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.58 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 46.5 t80 -78.91 -58.95 2.98 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.228 -0.92 . . . . 0.0 111.618 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -58.61 -36.46 74.05 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.661 -1.275 . . . . 0.0 109.898 -178.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.0 tp -62.77 -43.0 99.94 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 61' ' ' ASN . 60.7 t80 -61.16 -69.94 0.21 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.815 -0.553 . . . . 0.0 109.56 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.745 HD21 ' H ' ' A' ' 61' ' ' ASN . 1.2 m-80 -42.73 -37.24 1.69 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.323 -0.86 . . . . 0.0 109.732 -179.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.5 mt -67.33 -51.8 48.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.419 ' CG2' ' CE2' ' A' ' 102' ' ' TYR . 38.8 t -57.92 -43.99 85.72 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.702 -0.624 . . . . 0.0 109.605 179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.44 ' CD1' ' OE1' ' A' ' 110' ' ' GLU . 14.2 mm -69.06 -37.88 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -17.55 32.76 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 120.269 -0.573 . . . . 0.0 109.794 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -97.87 4.35 49.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.838 -1.164 . . . . 0.0 109.361 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.61 12.32 80.36 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.107 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 133.2 138.33 4.03 Favored Glycine 0 N--CA 1.504 3.202 0 O-C-N 120.512 -1.581 . . . . 0.0 111.701 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -50.75 -43.07 58.13 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.766 -0.844 . . . . 0.0 111.349 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.8 t -60.03 -42.16 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 120.73 -1.231 . . . . 0.0 110.062 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -55.43 -37.98 68.38 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.012 -1.055 . . . . 0.0 109.313 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 76' ' ' LYS . 54.5 t -64.3 -43.62 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.584 -0.698 . . . . 0.0 109.936 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.435 HD11 HG21 ' A' ' 73' ' ' ILE . 94.5 mt -66.34 -58.2 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.854 -1.153 . . . . 0.0 110.987 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -57.12 -41.48 79.08 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.034 -1.041 . . . . 0.0 110.344 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -93.06 -10.57 35.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.95 . . . . 0.0 110.608 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.598 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.8 mttp 59.18 60.6 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -0.825 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.43 13.39 17.69 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.911 -1.118 . . . . 0.0 108.107 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.45 ' O ' ' N ' ' A' ' 82' ' ' ILE . 85.1 m95 -63.05 -41.32 99.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.352 -0.842 . . . . 0.0 109.398 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 99.3 mm-40 -50.62 -36.7 36.52 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 118.054 -1.458 . . . . 0.0 108.112 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.0 mm-40 -71.17 -43.34 67.66 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.0 mt -67.8 -54.16 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.45 ' N ' ' O ' ' A' ' 78' ' ' TRP . 59.3 mt -53.13 -54.58 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -67.79 -40.55 83.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.174 -0.954 . . . . 0.0 109.32 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.38 -32.22 44.5 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.6 mt -89.57 -7.73 54.22 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.469 -1.018 . . . . 0.0 108.631 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 65.12 40.8 4.85 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.308 0.575 . . . . 0.0 110.097 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 30.1 mt -72.47 148.77 90.81 Favored Pre-proline 0 N--CA 1.489 1.477 0 O-C-N 121.219 -0.926 . . . . 0.0 108.955 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.49 164.61 33.62 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.328 2.019 . . . . 0.0 112.129 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.8 m -82.66 -0.03 45.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.0 108.855 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 m -65.49 -33.4 75.83 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.601 -0.687 . . . . 0.0 110.235 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.436 HG22 HD13 ' A' ' 91' ' ' ILE . 89.3 mt -91.51 100.43 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.672 -1.267 . . . . 0.0 109.312 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 67.1 p -72.24 -23.32 61.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.272 -0.892 . . . . 0.0 109.139 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.0 m -101.55 40.67 1.28 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.492 -0.755 . . . . 0.0 109.156 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -63.08 1.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 108.853 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -46.36 -50.91 15.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.539 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.407 ' O ' ' OG1' ' A' ' 100' ' ' THR . 5.6 tp -58.71 -42.47 88.75 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.788 -1.195 . . . . 0.0 109.171 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.7 m -62.42 -41.17 98.5 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.127 -0.983 . . . . 0.0 108.819 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.5 mt -69.57 -48.35 60.58 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.722 -0.611 . . . . 0.0 109.816 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.711 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -63.35 -51.08 67.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.239 -0.913 . . . . 0.0 110.974 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 6.5 m -55.64 -55.12 35.8 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.236 -0.915 . . . . 0.0 109.792 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -63.3 -42.02 99.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -0.887 . . . . 0.0 111.477 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.419 ' CE2' ' CG2' ' A' ' 63' ' ' VAL . 5.2 t80 -57.83 -40.94 81.21 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.278 -1.514 . . . . 0.0 109.321 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' MET . . . . . 0.46 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.5 ttm -53.01 -56.85 12.98 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.555 -0.715 . . . . 0.0 111.566 -178.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mttm -74.58 -52.65 11.22 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.871 -1.143 . . . . 0.0 113.151 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.25 -47.76 11.19 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 11.2 mp -97.11 -3.2 41.61 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.169 -1.582 . . . . 0.0 113.4 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 74.8 t80 -64.14 -35.77 16.72 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 119.981 -1.699 . . . . 0.0 109.876 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 25.7 Cg_exo -63.6 -55.13 0.75 Allowed 'Trans proline' 0 N--CA 1.5 1.888 0 C-N-CA 122.427 2.085 . . . . 0.0 112.545 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.405 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 3.2 t80 -57.82 -46.14 85.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.42 -0.8 . . . . 0.0 109.212 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 64' ' ' ILE . 3.4 tp10 -66.25 -53.57 35.33 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.317 -0.864 . . . . 0.0 109.727 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.6 t -67.24 -45.38 76.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 110.353 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -67.26 -48.91 66.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.165 -0.96 . . . . 0.0 111.379 -178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -73.57 -32.45 64.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.107 -0.996 . . . . 0.0 112.246 -177.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.2 tppt? -125.18 -27.54 3.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.888 -1.132 . . . . 0.0 111.854 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.59 45.47 24.77 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.742 -1.224 . . . . 0.0 110.528 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.9 mt -68.05 -28.39 67.34 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.029 -1.044 . . . . 0.0 110.943 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -152.49 -167.01 2.63 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 118.733 -1.187 . . . . 0.0 111.607 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.534 ' N ' ' OG ' ' A' ' 117' ' ' SER . 76.7 p -131.41 158.55 74.98 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.661 -0.649 . . . . 0.0 109.914 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.498 ' N ' ' HH ' ' A' ' 107' ' ' TYR . 31.2 Cg_exo -55.11 -40.4 86.01 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.671 1.581 . . . . 0.0 112.437 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.77 -38.9 92.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.782 -1.199 . . . . 0.0 109.788 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.6 mt-10 -65.09 -41.06 95.34 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.2 tp -69.36 -50.34 47.18 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.684 -0.635 . . . . 0.0 110.219 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -58.35 -46.55 86.03 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.054 -1.028 . . . . 0.0 109.729 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.32 -42.34 98.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.373 -0.829 . . . . 0.0 110.408 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.12 -33.5 74.62 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.087 -1.008 . . . . 0.0 108.429 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.502 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.3 mt -64.67 -49.52 79.95 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.962 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.51 -38.22 86.57 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.78 75.82 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.711 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 29.6 p30 -94.13 -28.25 15.79 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.266 -1.137 . . . . 0.0 110.456 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.1 mtp180 . . . . . 0 N--CA 1.494 1.742 0 O-C-N 120.766 -1.209 . . . . 0.0 109.491 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.593 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 9.4 mm-40 . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -50.91 -47.44 60.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 0.0 109.535 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -61.36 -42.28 98.45 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.179 -0.951 . . . . 0.0 109.469 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -67.0 -51.53 53.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.179 -0.95 . . . . 0.0 111.194 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.7 p -71.74 -39.61 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.256 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -58.92 -38.9 80.02 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.099 -1.626 . . . . 0.0 108.155 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.495 ' NE2' ' OE1' ' A' ' 18' ' ' GLU . 19.3 mm-40 -60.71 -31.32 70.61 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.648 178.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.4 mt -64.55 -39.15 93.23 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 110.734 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -79.57 -34.98 40.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.561 -1.337 . . . . 0.0 109.835 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.495 ' OE1' ' NE2' ' A' ' 15' ' ' GLN . 97.7 mt-10 -64.8 -29.22 70.18 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.063 -1.023 . . . . 0.0 110.601 -178.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.488 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 16.5 mt -37.82 -39.94 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.518 -0.739 . . . . 0.0 110.897 -178.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 0.9 OUTLIER -173.02 164.97 4.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.649 -1.282 . . . . 0.0 110.677 -179.159 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -92.14 67.18 4.99 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.838 -0.539 . . . . 0.0 110.078 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.33 102.87 54.14 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.36 -48.83 14.25 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.952 1.768 . . . . 0.0 112.341 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.04 -37.1 81.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.996 -1.065 . . . . 0.0 108.919 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.593 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.2 ttt-85 -60.33 -42.89 96.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.306 -0.871 . . . . 0.0 109.439 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -62.22 -52.61 63.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.991 -1.068 . . . . 0.0 109.644 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -52.26 -35.04 48.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 0.0 109.288 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.98 -62.69 1.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.639 0.733 . . . . 0.0 110.549 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 14.6 mt -57.38 -43.21 83.42 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.643 -0.661 . . . . 0.0 109.365 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -58.94 -50.75 72.88 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.211 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -66.99 -44.03 81.44 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.341 -0.85 . . . . 0.0 110.333 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.411 HD13 ' CD2' ' A' ' 109' ' ' TYR . 62.4 tp -57.96 -50.42 73.44 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.94 . . . . 0.0 110.381 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -60.85 -34.23 74.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.154 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -67.03 -54.66 19.49 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.336 -0.852 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.53 -38.98 86.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.661 -179.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mmm -59.47 -39.41 83.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 111.512 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.739 -1.225 . . . . 0.0 110.783 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -64.96 -44.05 90.66 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.031 -1.043 . . . . 0.0 109.509 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.437 HH11 ' HB3' ' A' ' 108' ' ' PRO . 7.8 mtp180 -63.2 -25.47 68.35 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.963 -177.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.21 0.23 55.91 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 107.977 -2.049 . . . . 0.0 107.977 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 50.1 p -115.61 83.9 11.74 Favored Pre-proline 0 N--CA 1.49 1.56 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -85.08 142.73 8.86 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.647 2.232 . . . . 0.0 111.084 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.437 HG23 HD12 ' A' ' 43' ' ' ILE . 45.2 mt -78.88 94.53 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 C-N-CA 118.795 -1.162 . . . . 0.0 109.329 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.593 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 82.1 m-20 -65.97 -32.89 74.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -151.23 133.28 15.16 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.45 146.76 92.08 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 120.784 -1.197 . . . . 0.0 109.267 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.54 104.16 1.76 Allowed 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 121.636 1.558 . . . . 0.0 109.735 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.2 mt -72.7 142.4 15.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.082 -1.011 . . . . 0.0 110.202 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mmm -138.51 127.96 24.61 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.782 0.801 . . . . 0.0 108.972 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.32 40.04 8.94 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 59.42 22.62 11.1 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.321 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.8 m -137.1 155.4 49.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.182 -0.949 . . . . 0.0 109.512 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 m -65.82 143.4 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.81 -1.181 . . . . 0.0 108.836 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.1 tp -77.76 124.45 27.97 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.17 -0.956 . . . . 0.0 109.135 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -65.17 91.64 0.1 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.569 -0.707 . . . . 0.0 110.045 -178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.3 mt -53.89 -25.14 18.59 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 120.99 -1.068 . . . . 0.0 108.848 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.48 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 46.9 t80 -79.38 -57.85 3.5 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 111.685 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.13 -39.25 91.92 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.659 -1.276 . . . . 0.0 110.153 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.02 -40.98 91.15 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.829 -1.169 . . . . 0.0 108.352 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -61.56 -67.17 0.43 Allowed 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.48 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 88.0 m-20 -43.06 -39.75 2.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.482 -0.761 . . . . 0.0 111.123 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -70.21 -46.58 64.25 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 117.656 -1.618 . . . . 0.0 107.356 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.489 ' CG2' ' CE2' ' A' ' 102' ' ' TYR . 33.8 t -57.61 -44.49 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 110.566 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.44 HG22 HD13 ' A' ' 64' ' ' ILE . 10.9 mm -70.16 -34.2 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 120.508 -1.37 . . . . 0.0 108.007 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.18 -20.44 26.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.82 -0.55 . . . . 0.0 110.232 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.567 HH21 ' CB ' ' A' ' 80' ' ' GLU . 14.6 mmt-85 -94.53 2.07 55.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.713 -1.242 . . . . 0.0 108.732 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.97 14.4 77.37 Favored Glycine 0 N--CA 1.493 2.438 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.154 177.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.61 2.96 Favored Glycine 0 N--CA 1.501 2.974 0 O-C-N 120.519 -1.577 . . . . 0.0 111.316 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 tp -50.11 -40.91 47.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.65 -0.912 . . . . 0.0 110.754 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.99 -41.54 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.903 -1.123 . . . . 0.0 109.863 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -56.4 -39.84 73.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.995 -1.065 . . . . 0.0 108.877 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 76' ' ' LYS . 98.2 t -64.99 -44.26 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.544 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.44 -52.54 40.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.821 0 O-C-N 120.862 -1.149 . . . . 0.0 110.01 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.449 HD22 ' CB ' ' A' ' 125' ' ' ALA . 4.5 m120 -57.73 -42.97 84.95 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.995 -1.066 . . . . 0.0 110.35 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -94.94 -8.88 35.75 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 72' ' ' VAL . 37.7 mtmt 59.04 60.69 2.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.338 -0.851 . . . . 0.0 109.703 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.7 mt -90.9 17.63 7.59 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.443 ' O ' ' N ' ' A' ' 82' ' ' ILE . 97.9 m95 -64.48 -43.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.537 179.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 78' ' ' TRP . 50.8 mt-30 -48.21 -38.83 19.31 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.254 -1.379 . . . . 0.0 108.35 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.567 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.0 mm-40 -66.39 -40.79 89.87 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -72.41 -52.32 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.443 ' N ' ' O ' ' A' ' 78' ' ' TRP . 45.9 mt -52.96 -52.55 27.86 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -72.3 -40.7 67.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.479 -0.763 . . . . 0.0 109.899 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.75 -34.87 45.24 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.8 mt -89.71 -7.96 53.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -1.075 . . . . 0.0 108.888 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 67.22 38.5 3.33 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.34 0.591 . . . . 0.0 109.546 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.66 120.08 78.73 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.407 -0.808 . . . . 0.0 108.967 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.516 ' C ' ' H ' ' A' ' 90' ' ' SER . 50.8 Cg_exo -47.79 139.16 19.51 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.767 1.645 . . . . 0.0 112.694 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 83.4 p -60.84 0.91 0.17 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.344 -0.848 . . . . 0.0 109.887 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.516 ' H ' ' C ' ' A' ' 88' ' ' PRO . 6.0 m -62.7 -33.04 74.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.146 -0.971 . . . . 0.0 109.503 -178.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.456 HG23 HD13 ' A' ' 91' ' ' ILE . 85.7 mt -87.2 101.12 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.826 -1.171 . . . . 0.0 108.937 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 39.1 p -68.18 -29.31 68.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.311 -0.868 . . . . 0.0 109.132 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -94.79 39.96 1.1 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.53 -0.731 . . . . 0.0 109.067 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.404 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -62.77 -64.62 0.86 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.14 -0.975 . . . . 0.0 108.931 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.43 -51.98 24.22 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.342 -0.849 . . . . 0.0 109.6 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -58.61 -47.38 84.52 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.732 -1.23 . . . . 0.0 109.628 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.1 m -59.51 -40.1 86.02 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.032 -1.043 . . . . 0.0 108.842 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.6 mt -71.05 -45.45 63.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.659 -0.651 . . . . 0.0 110.255 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -67.28 -50.67 59.42 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.841 -1.162 . . . . 0.0 110.952 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.3 m -55.99 -54.8 40.52 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.163 -0.961 . . . . 0.0 110.081 -178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -61.99 -40.57 96.07 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.105 -0.997 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.489 ' CE2' ' CG2' ' A' ' 63' ' ' VAL . 6.8 t80 -57.58 -39.82 77.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.21 -1.556 . . . . 0.0 109.402 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.7 ttm -55.58 -55.94 26.16 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.393 -0.817 . . . . 0.0 112.246 -178.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -72.85 -52.05 16.34 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.627 -1.296 . . . . 0.0 112.823 -176.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -83.69 -43.19 15.8 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -175.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.459 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 10.0 mp -99.63 -7.25 26.0 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.283 -1.511 . . . . 0.0 114.238 -176.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.652 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 46.5 t80 -62.3 -36.92 31.94 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 119.686 -1.884 . . . . 0.0 109.727 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.652 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.9 Cg_exo -65.69 -56.81 0.29 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.242 1.961 . . . . 0.0 112.091 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.411 ' CD2' HD13 ' A' ' 32' ' ' LEU . 8.6 t80 -59.31 -35.93 74.7 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -71.8 -56.21 6.17 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.732 -0.605 . . . . 0.0 110.309 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.5 OUTLIER -69.96 -41.53 74.36 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.304 -0.872 . . . . 0.0 110.1 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 45.4 tp10 -66.57 -49.52 66.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.261 -0.9 . . . . 0.0 110.799 -178.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -74.67 -30.22 61.52 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.088 -1.008 . . . . 0.0 111.513 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -125.35 -27.63 3.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.004 -1.06 . . . . 0.0 112.115 -177.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' A' ' 111' ' ' CYS . 29.9 t30 57.04 45.42 21.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.579 -1.326 . . . . 0.0 110.065 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.55 -33.24 74.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.116 -0.99 . . . . 0.0 111.431 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.558 ' OG ' ' N ' ' A' ' 118' ' ' THR . 27.6 t -154.28 -166.11 2.27 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.598 -1.241 . . . . 0.0 111.75 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.558 ' N ' ' OG ' ' A' ' 117' ' ' SER . 81.9 p -124.67 152.24 68.88 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.888 -0.508 . . . . 0.0 109.754 -178.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.66 -38.71 91.08 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.2 1.933 . . . . 0.0 112.326 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.65 88.11 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.874 -1.141 . . . . 0.0 109.427 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.494 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.2 mt-10 -65.78 -42.09 91.2 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 13.0 tp -67.56 -51.72 47.24 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.686 -0.634 . . . . 0.0 109.871 178.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.12 -45.67 79.44 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.948 -1.095 . . . . 0.0 108.289 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.35 89.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.421 -0.799 . . . . 0.0 109.201 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.449 ' CB ' HD22 ' A' ' 74' ' ' ASN . . . -67.76 -36.63 80.87 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.527 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.9 mt -64.1 -48.72 84.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -62.22 -37.64 86.15 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.957 -1.09 . . . . 0.0 108.256 178.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.65 -33.27 84.43 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.641 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 28.1 p-10 -92.27 -31.63 15.33 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.9 -1.353 . . . . 0.0 110.424 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.641 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 81.8 mtm180 . . . . . 0 N--CA 1.49 1.544 0 O-C-N 120.613 -1.305 . . . . 0.0 109.418 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -114.74 89.54 3.12 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.421 -1.046 . . . . 0.0 109.338 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.57 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -113.13 137.35 51.57 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.381 -0.824 . . . . 0.0 109.603 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -56.94 -37.87 72.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.406 -0.809 . . . . 0.0 109.997 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.28 -43.93 96.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.996 -1.065 . . . . 0.0 108.744 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.57 ' H ' ' HG ' ' A' ' 5' ' ' SER . 99.1 mt-10 -56.96 -39.41 74.52 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.373 -0.83 . . . . 0.0 109.014 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.586 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 19.8 mm-40 -74.0 -34.87 64.34 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.265 -0.897 . . . . 0.0 109.271 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.18 -49.38 74.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.952 -1.092 . . . . 0.0 109.83 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.6 mtmm -60.74 -35.63 76.84 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.035 -1.041 . . . . 0.0 108.911 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -66.35 -49.99 65.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.55 -0.719 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.28 -35.86 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 120.771 -1.206 . . . . 0.0 108.901 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.572 ' NH1' ' OE2' ' A' ' 18' ' ' GLU . 0.5 OUTLIER -54.83 -40.47 69.61 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.409 ' HA ' HE21 ' A' ' 15' ' ' GLN . 7.4 mm-40 -59.76 -31.64 69.84 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.1 mt -70.77 -37.31 73.35 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.354 -0.841 . . . . 0.0 111.129 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.524 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.3 m-85 -79.25 -33.0 43.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.487 -1.383 . . . . 0.0 110.329 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.572 ' OE2' ' NH1' ' A' ' 14' ' ' ARG . 97.8 mt-10 -66.24 -30.06 70.43 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.915 -1.115 . . . . 0.0 110.45 -178.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.475 ' C ' ' O ' ' A' ' 18' ' ' GLU . 23.9 mt -36.17 -40.39 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 O-C-N 121.719 -0.613 . . . . 0.0 110.687 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -171.68 164.6 6.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.654 -1.279 . . . . 0.0 110.766 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -90.79 65.6 5.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.748 -0.595 . . . . 0.0 110.103 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.569 ' OD1' ' N ' ' A' ' 25' ' ' ARG . 10.8 t70 -112.42 95.72 32.75 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.351 -0.843 . . . . 0.0 108.847 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.46 -41.72 35.92 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.369 2.046 . . . . 0.0 112.217 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -60.06 -41.0 91.42 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.208 -0.932 . . . . 0.0 108.486 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.574 HH22 ' CG ' ' A' ' 55' ' ' ASP . 67.4 ttt180 -61.32 -38.96 88.77 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.631 -0.668 . . . . 0.0 110.134 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -59.88 -48.89 79.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.191 -0.943 . . . . 0.0 109.41 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -53.46 -38.49 63.63 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.51 -0.744 . . . . 0.0 109.367 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -64.55 -61.25 2.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.976 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.481 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 49.1 mt -55.47 -46.67 76.82 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.334 -0.854 . . . . 0.0 108.781 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.524 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 82.7 m-20 -62.0 -49.11 77.36 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.219 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.471 ' O ' ' OG ' ' A' ' 34' ' ' SER . 53.3 t0 -66.7 -42.44 86.42 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -57.89 -50.37 73.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.103 -0.998 . . . . 0.0 110.192 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 46.6 m-85 -61.19 -35.21 76.54 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 118.064 -1.454 . . . . 0.0 107.54 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 31' ' ' ASP . 32.3 p -70.76 -53.62 14.78 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.716 0.77 . . . . 0.0 109.371 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.458 ' CD1' ' NZ ' ' A' ' 38' ' ' LYS . 43.9 t80 -57.4 -44.02 84.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.701 -0.624 . . . . 0.0 110.402 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mmm -56.71 -34.46 67.48 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.365 -0.834 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.423 ' C ' ' OE1' ' A' ' 37' ' ' GLN . 5.2 tm0? -54.43 -41.68 69.65 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.458 ' NZ ' ' CD1' ' A' ' 35' ' ' PHE . 6.6 ttpm? -67.07 -40.09 86.97 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.498 -0.751 . . . . 0.0 109.578 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.8 mmm180 -64.41 -30.76 71.8 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.811 -0.556 . . . . 0.0 109.913 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.24 0.71 65.23 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.1 p -117.17 85.25 18.46 Favored Pre-proline 0 N--CA 1.488 1.44 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -83.47 145.97 12.03 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.537 2.158 . . . . 0.0 111.281 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 15.7 mt -86.9 104.81 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 120.921 -1.112 . . . . 0.0 110.475 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.606 ' O ' ' NE ' ' A' ' 45' ' ' ARG . 79.5 m-20 -85.34 -10.26 56.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.606 ' NE ' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -156.21 117.54 3.86 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.475 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mt -70.82 138.23 85.44 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 120.463 -1.398 . . . . 0.0 108.949 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -52.76 133.93 52.36 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 N-CA-C 109.391 -1.042 . . . . 0.0 109.391 176.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.555 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 5.8 mt -105.14 149.36 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.967 -1.083 . . . . 0.0 109.775 -179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.41 ' SD ' ' CD2' ' A' ' 87' ' ' LEU . 22.9 mtt -142.23 120.9 12.59 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.45 41.79 7.22 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 70.9 mttt 60.45 27.13 16.74 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.322 0.582 . . . . 0.0 109.597 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 86.6 p -137.33 154.67 50.01 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 109.417 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 m -69.31 147.22 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 109.687 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.555 ' CD2' ' OE1' ' A' ' 101' ' ' GLN . 57.4 tp -84.36 127.89 34.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.345 -0.847 . . . . 0.0 109.539 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.574 ' CG ' HH22 ' A' ' 25' ' ' ARG . 4.6 m-20 -66.31 90.33 0.15 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.377 -0.827 . . . . 0.0 109.575 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.7 mt -55.57 -25.27 37.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.976 -1.078 . . . . 0.0 109.601 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -76.3 -54.64 6.49 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.227 -0.921 . . . . 0.0 111.636 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.31 -37.5 83.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.778 -1.201 . . . . 0.0 109.739 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.9 tp -58.8 -44.72 90.86 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.983 -1.073 . . . . 0.0 108.278 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.415 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.6 t80 -56.73 -68.06 0.25 Allowed 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.73 -0.606 . . . . 0.0 109.848 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -42.7 -39.87 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.371 -0.831 . . . . 0.0 111.415 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.416 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 6.1 mt -71.24 -44.35 65.49 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 118.144 -1.422 . . . . 0.0 107.628 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.406 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.4 t -59.16 -46.11 92.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.282 -0.886 . . . . 0.0 109.848 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.415 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -67.98 -35.83 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.711 -1.243 . . . . 0.0 108.414 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.418 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.75 -25.82 20.53 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.985 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.59 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.6 mpt_? -91.3 -2.9 57.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.564 -1.335 . . . . 0.0 109.109 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.31 20.55 56.77 Favored Glycine 0 N--CA 1.492 2.42 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.227 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.97 132.64 3.09 Favored Glycine 0 N--CA 1.5 2.914 0 O-C-N 120.503 -1.586 . . . . 0.0 111.407 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tp -49.85 -38.35 34.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.645 -0.915 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.15 -42.79 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.912 -1.117 . . . . 0.0 110.814 -178.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -56.34 -39.08 72.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.776 -1.203 . . . . 0.0 109.218 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 49.5 t -63.34 -43.59 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.756 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.441 HG21 HD12 ' A' ' 73' ' ' ILE . 83.6 mt -66.04 -57.16 11.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 O-C-N 120.834 -1.166 . . . . 0.0 110.284 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.416 HD22 ' CB ' ' A' ' 125' ' ' ALA . 13.5 m120 -57.1 -42.85 81.54 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.268 -0.895 . . . . 0.0 110.28 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -94.44 -7.31 41.82 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.924 . . . . 0.0 111.292 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.6 mttm 58.8 58.33 3.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.299 -0.876 . . . . 0.0 110.589 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.0 mt -91.81 13.82 17.23 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.779 -1.2 . . . . 0.0 108.51 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.404 ' O ' ' C ' ' A' ' 79' ' ' GLN . 84.0 m95 -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.372 -0.83 . . . . 0.0 108.777 178.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.55 ' NE2' ' OP1' ' C' ' 419' ' ' ' DC' . 9.4 mp0 -50.15 -40.18 45.68 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 120.618 -1.302 . . . . 0.0 108.342 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.59 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.3 mt-10 -68.51 -40.59 80.77 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.083 -1.011 . . . . 0.0 108.302 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.35 -52.15 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.07 -53.61 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.519 -0.738 . . . . 0.0 109.354 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 86' ' ' HIS . 26.1 mmtp -72.01 -39.59 69.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.0 109.888 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -50.63 -31.57 22.82 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.63 -6.83 51.57 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.439 -1.036 . . . . 0.0 109.127 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 83' ' ' LYS . 41.9 m-70 65.86 41.12 3.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.776 -0.578 . . . . 0.0 109.921 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' CD2' ' SD ' ' A' ' 49' ' ' MET . 12.0 mt -73.02 147.78 88.62 Favored Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.405 -0.81 . . . . 0.0 109.339 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.9 Cg_endo -73.29 141.47 32.17 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 C-N-CA 122.353 2.035 . . . . 0.0 112.368 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.7 p -62.25 -0.78 0.6 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.833 . . . . 0.0 109.987 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.453 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.0 p -65.79 -23.51 66.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.09 -1.006 . . . . 0.0 109.934 -178.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.439 HD12 HG23 ' A' ' 91' ' ' ILE . 80.2 mt -98.3 105.96 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 120.96 -1.088 . . . . 0.0 109.224 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 50.6 p -76.19 -25.66 55.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 109.054 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.1 m -96.05 34.64 1.53 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.546 -0.721 . . . . 0.0 109.259 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.29 -64.43 0.95 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.43 -51.68 25.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.315 -0.865 . . . . 0.0 109.269 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.88 -43.15 90.84 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.801 -1.187 . . . . 0.0 108.954 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.7 m -60.11 -40.14 88.63 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.085 -1.009 . . . . 0.0 108.426 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.55 -46.54 63.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.664 -0.647 . . . . 0.0 109.675 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.584 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.6 ttm180 -66.32 -52.09 50.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.905 -1.122 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 50.2 m -55.69 -54.09 48.53 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.133 -0.979 . . . . 0.0 110.228 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.555 ' OE1' ' CD2' ' A' ' 54' ' ' LEU . 1.0 OUTLIER -65.67 -43.68 88.57 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.975 -1.078 . . . . 0.0 112.012 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 110' ' ' GLU . 3.5 t80 -55.68 -41.72 74.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.06 -1.65 . . . . 0.0 108.893 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.7 mtp -53.14 -50.72 63.96 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.514 -0.741 . . . . 0.0 110.621 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 32.1 mttm -72.37 -53.95 10.82 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.031 -1.043 . . . . 0.0 112.875 -177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -85.51 -52.63 5.71 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 -174.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 9.1 mp -94.53 2.82 55.68 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.303 -1.498 . . . . 0.0 113.796 -175.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.635 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.1 t80 -62.98 -35.96 21.89 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 120.048 -1.657 . . . . 0.0 110.405 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.635 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 12.3 Cg_exo -68.53 -54.21 0.3 Allowed 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.13 1.887 . . . . 0.0 112.31 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.436 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 0.8 OUTLIER -56.97 -47.61 80.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.391 -0.818 . . . . 0.0 109.299 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 87.2 tt0 -68.89 -44.83 72.43 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.169 -0.957 . . . . 0.0 110.562 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.3 t -81.04 -45.97 15.74 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.977 -1.077 . . . . 0.0 111.244 -178.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 108' ' ' PRO . 44.1 tp10 -67.76 -51.7 45.9 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.634 -1.291 . . . . 0.0 111.518 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -73.72 -33.14 64.23 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.855 -1.153 . . . . 0.0 111.797 -178.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.1 tptt -114.55 -29.48 6.82 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.833 -1.167 . . . . 0.0 111.784 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 111' ' ' CYS . 53.5 t30 57.29 44.79 21.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.6 -1.313 . . . . 0.0 110.288 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.08 -30.06 70.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.223 -0.923 . . . . 0.0 110.581 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.708 ' HG ' ' H ' ' A' ' 118' ' ' THR . 30.6 t -154.47 -167.25 2.56 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.917 -178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.708 ' H ' ' HG ' ' A' ' 117' ' ' SER . 82.1 p -129.01 159.49 68.47 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.515 -0.741 . . . . 0.0 109.672 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -55.52 -40.29 86.3 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.595 1.53 . . . . 0.0 112.207 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.29 -37.59 87.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.015 -1.053 . . . . 0.0 109.379 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.494 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.28 -46.06 74.75 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 17.6 tp -65.61 -53.28 43.85 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.404 -0.81 . . . . 0.0 109.942 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -56.86 -44.49 82.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.054 . . . . 0.0 108.907 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.05 85.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.114 -0.991 . . . . 0.0 109.155 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.416 ' CB ' HD22 ' A' ' 74' ' ' ASN . . . -68.28 -35.97 78.67 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 29.4 mt -64.09 -49.82 79.72 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.14 -38.46 86.48 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.88 88.67 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.656 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.05 -31.68 14.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.073 -1.251 . . . . 0.0 110.078 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.656 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.2 mtp180 -63.91 145.48 55.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.853 -1.154 . . . . 0.0 109.607 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.527 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -63.83 140.1 58.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.389 -0.82 . . . . 0.0 109.292 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -66.52 -19.95 65.91 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.162 -0.961 . . . . 0.0 109.444 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.724 0 O4'-C1'-C2' 108.31 2.009 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.4 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.262 0 O4'-C4'-C3' 107.853 2.253 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.871 0 O4'-C4'-C3' 107.625 2.025 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.119 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.917 0 O5'-C5'-C4' 113.052 2.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.796 0 O5'-C5'-C4' 112.976 1.983 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.636 0 O5'-C5'-C4' 113.221 2.158 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.555 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.143 0 O4'-C4'-C3' 107.754 2.154 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.906 0 O5'-C5'-C4' 113.283 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.248 0 O4'-C1'-C2' 108.566 2.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.85 0 O5'-C5'-C4' 113.205 2.147 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.078 0 O5'-C5'-C4' 113.439 2.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.055 0 O4'-C4'-C3' 107.797 2.197 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.777 0 O4'-C4'-C3' 107.561 1.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O4'-C4'-C3' 108.004 2.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.831 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.939 0 O4'-C1'-C2' 109.038 2.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.362 0 C4'-C3'-C2' 105.696 2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.493 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 1.972 0 O5'-C5'-C4' 112.8 1.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.55 ' OP1' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.523 1.542 0 O5'-C5'-C4' 113.653 2.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.558 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.844 0 O4'-C4'-C3' 107.958 2.358 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O4'-C4'-C3' 107.782 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O5'-C5'-C4' 113.468 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.802 0 O5'-C5'-C4' 113.671 2.48 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C1'-C2' 108.839 2.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.234 0 O4'-C4'-C3' 108.035 2.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.322 0 O4'-C4'-C3' 107.585 1.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.498 0 O4'-C4'-C3' 107.729 2.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.894 0 O5'-C5'-C4' 112.933 1.952 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C4'-C3' 107.751 2.151 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.162 0 C1'-O4'-C4' 106.174 -2.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.594 ' CZ2' ' ND2' ' A' ' 44' ' ' ASN . 32.0 p90 -96.38 108.78 21.36 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.369 -1.077 . . . . 0.0 109.524 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.2 p -62.62 158.93 17.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.173 -0.955 . . . . 0.0 110.109 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -58.61 -28.9 66.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.614 -0.678 . . . . 0.0 109.873 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.61 -47.98 82.97 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.05 -1.031 . . . . 0.0 109.074 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -49.79 -40.45 41.64 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.3 mp0 -74.25 -36.79 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.482 -0.761 . . . . 0.0 109.009 178.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -48.51 -52.58 21.77 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.882 . . . . 0.0 109.81 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -61.22 -39.92 92.07 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.2 -0.938 . . . . 0.0 108.9 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.52 -49.18 67.38 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.365 -0.834 . . . . 0.0 110.798 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.418 ' O ' ' N ' ' A' ' 16' ' ' LEU . 2.7 m -70.96 -37.79 69.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 120.497 -1.377 . . . . 0.0 108.789 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -53.3 -39.21 63.83 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.592 -1.317 . . . . 0.0 107.761 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -58.93 -31.47 68.71 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' VAL . 8.3 mt -72.48 -38.75 68.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.281 -0.887 . . . . 0.0 111.504 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.496 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.5 m-85 -76.49 -33.24 58.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.433 -1.417 . . . . 0.0 110.314 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.479 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.5 mm-40 -66.98 -26.63 66.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.967 -1.083 . . . . 0.0 110.55 -178.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.479 ' C ' ' O ' ' A' ' 18' ' ' GLU . 32.2 mt -37.56 -38.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 O-C-N 121.798 -0.564 . . . . 0.0 110.487 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.72 161.62 7.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.858 -1.151 . . . . 0.0 110.323 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.7 p30 -88.99 66.52 7.88 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.539 0.685 . . . . 0.0 109.342 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -112.04 93.56 21.93 Favored Pre-proline 0 N--CA 1.489 1.503 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -47.1 -37.98 23.92 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.238 1.958 . . . . 0.0 112.004 -178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -62.77 -40.17 96.47 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.241 -0.912 . . . . 0.0 108.829 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.516 HH22 ' CG ' ' A' ' 55' ' ' ASP . 62.6 ttt180 -61.35 -37.08 82.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.478 -0.763 . . . . 0.0 110.454 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -60.16 -50.71 72.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.131 -0.981 . . . . 0.0 109.428 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -53.25 -38.77 63.32 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.431 -0.793 . . . . 0.0 109.677 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -62.01 -62.91 1.45 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.369 -0.832 . . . . 0.0 110.803 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 49.9 mt -55.57 -44.16 76.61 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.448 -0.782 . . . . 0.0 109.414 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.496 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 92.9 m-20 -60.99 -48.57 81.22 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.185 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.68 -42.73 86.04 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.132 -0.98 . . . . 0.0 109.546 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.48 -53.19 60.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.29 -0.881 . . . . 0.0 110.333 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -62.3 -33.25 74.31 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 118.483 -1.287 . . . . 0.0 107.811 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -67.92 -56.59 8.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.617 -0.677 . . . . 0.0 109.663 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.401 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 49.4 t80 -60.78 -42.28 97.22 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.253 -0.904 . . . . 0.0 110.3 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.483 ' CE ' ' O ' ' A' ' 41' ' ' THR . 73.7 mmm -59.17 -40.54 85.92 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.534 -0.729 . . . . 0.0 110.912 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -60.44 -41.57 94.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.954 -1.092 . . . . 0.0 109.72 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -61.9 -47.44 84.95 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.576 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.429 HH11 ' HB3' ' A' ' 108' ' ' PRO . 13.2 mtp180 -64.38 -20.93 66.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.105 -0.997 . . . . 0.0 111.282 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.35 3.01 58.82 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.723 -1.751 . . . . 0.0 108.723 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.483 ' O ' ' CE ' ' A' ' 36' ' ' MET . 34.3 p -117.6 83.67 17.82 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.46 -1.024 . . . . 0.0 108.874 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -91.57 139.84 2.39 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 123.054 2.503 . . . . 0.0 112.146 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 78.3 mt -73.46 99.0 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.02 -1.05 . . . . 0.0 109.026 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 94.2 m-20 -64.82 -45.48 86.02 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -133.99 132.58 40.29 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mt -70.97 142.66 88.02 Favored Pre-proline 0 C--N 1.299 -1.607 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.702 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -66.69 134.02 33.76 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.221 1.281 . . . . 0.0 109.095 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.5 mt -100.15 145.71 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.884 -1.135 . . . . 0.0 110.068 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.408 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 80.7 mtp -141.56 118.84 11.42 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.408 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 69.43 43.13 1.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm 57.35 22.48 7.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.752 -0.593 . . . . 0.0 109.649 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.1 m -136.4 152.93 51.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 109.416 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.3 m -68.03 147.69 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 109.11 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.1 tp -79.45 123.17 27.28 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.412 -0.805 . . . . 0.0 110.369 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.516 ' CG ' HH22 ' A' ' 25' ' ' ARG . 12.1 m-20 -63.05 92.38 0.05 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.52 -0.738 . . . . 0.0 109.495 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.53 -27.57 57.83 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.989 -1.069 . . . . 0.0 109.718 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -78.21 -59.97 2.56 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.067 -1.021 . . . . 0.0 111.615 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -58.59 -36.33 73.83 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.743 -1.223 . . . . 0.0 109.871 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.93 -42.86 99.94 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.436 ' O ' ' C ' ' A' ' 61' ' ' ASN . 67.2 t80 -62.83 -68.08 0.37 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 60' ' ' TYR . 61.8 t30 -42.78 -34.67 0.97 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.469 -0.769 . . . . 0.0 109.35 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.519 ' CD2' HH22 ' A' ' 66' ' ' ARG . 13.6 mt -71.66 -50.89 26.33 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.443 HG22 ' CE2' ' A' ' 102' ' ' TYR . 37.6 t -56.6 -43.14 77.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.494 -0.754 . . . . 0.0 110.067 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.435 HG21 HD11 ' A' ' 64' ' ' ILE . 9.6 mm -69.68 -34.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.69 -1.256 . . . . 0.0 108.027 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.11 29.21 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.146 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.689 HH21 ' CB ' ' A' ' 80' ' ' GLU . 15.6 mmt-85 -95.13 -1.34 52.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.644 -1.285 . . . . 0.0 108.438 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.85 16.46 72.66 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.238 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.98 130.31 2.59 Favored Glycine 0 N--CA 1.502 3.049 0 CA-C-N 119.569 1.685 . . . . 0.0 111.618 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.1 tp -50.95 -41.83 59.34 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.631 -0.923 . . . . 0.0 110.465 -179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.0 t -57.86 -43.05 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.952 -1.092 . . . . 0.0 109.25 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -55.95 -37.5 69.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.111 -0.993 . . . . 0.0 108.656 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.1 t -66.73 -43.99 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.632 -0.667 . . . . 0.0 109.975 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.15 -57.58 9.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.759 -1.213 . . . . 0.0 110.124 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -58.02 -42.08 84.52 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.246 -0.909 . . . . 0.0 110.354 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.61 -9.02 39.44 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.279 -0.888 . . . . 0.0 110.692 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.626 ' N ' ' O ' ' A' ' 72' ' ' VAL . 25.1 mtmt 58.46 57.62 3.76 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.462 -0.773 . . . . 0.0 110.265 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.9 mt -91.37 12.63 19.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.951 -1.093 . . . . 0.0 108.594 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.487 ' O ' ' N ' ' A' ' 82' ' ' ILE . 87.6 m95 -61.11 -40.81 95.18 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt-30 -48.44 -40.93 27.9 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.898 -1.126 . . . . 0.0 108.749 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.689 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -66.61 -38.9 87.94 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.404 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.1 mt -72.9 -52.71 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.487 ' N ' ' O ' ' A' ' 78' ' ' TRP . 63.7 mt -54.15 -56.19 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.578 -0.701 . . . . 0.0 109.491 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 86' ' ' HIS . 44.9 mttp -66.68 -41.14 88.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.095 -1.003 . . . . 0.0 109.631 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.82 -30.67 29.58 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 mt -90.47 -8.78 49.59 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.428 -1.042 . . . . 0.0 109.099 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 83' ' ' LYS . 37.1 m-70 63.78 42.41 6.19 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.591 -0.693 . . . . 0.0 109.868 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.72 139.41 80.52 Favored Pre-proline 0 C--N 1.304 -1.405 0 O-C-N 121.242 -0.911 . . . . 0.0 108.583 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.611 ' C ' ' H ' ' A' ' 90' ' ' SER . 40.0 Cg_endo -69.93 142.95 48.56 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 121.915 1.743 . . . . 0.0 112.213 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.9 t -55.94 0.61 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.259 -0.901 . . . . 0.0 109.814 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.611 ' H ' ' C ' ' A' ' 88' ' ' PRO . 93.2 p -66.84 -26.0 66.7 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.222 -0.924 . . . . 0.0 110.193 -178.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.43 HG22 HD11 ' A' ' 91' ' ' ILE . 87.4 mt -101.47 107.41 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 120.92 -1.112 . . . . 0.0 109.522 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.9 p -79.05 -25.32 43.17 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.251 -0.905 . . . . 0.0 109.027 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -95.33 35.02 1.35 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.561 -0.712 . . . . 0.0 109.445 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.61 -65.2 0.73 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.138 -0.976 . . . . 0.0 108.631 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.17 -52.98 18.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.302 -0.874 . . . . 0.0 109.21 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.463 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 9.0 tp -58.95 -43.97 91.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.992 -1.067 . . . . 0.0 109.182 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 m -61.71 -39.96 93.36 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.953 -1.092 . . . . 0.0 108.692 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 12.0 mt -67.77 -44.22 77.96 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.562 -0.711 . . . . 0.0 110.068 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.778 ' NH1' HD22 ' A' ' 129' ' ' ASN . 28.6 ttm180 -68.81 -49.96 54.18 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.287 -0.883 . . . . 0.0 111.178 -179.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.525 ' H ' ' HG1' ' A' ' 100' ' ' THR . 0.6 OUTLIER -52.94 -53.18 53.27 Favored 'General case' 0 C--N 1.294 -1.837 0 C-N-CA 118.717 -1.193 . . . . 0.0 109.115 -178.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -63.83 -42.41 97.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.153 -0.967 . . . . 0.0 111.745 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.443 ' CE2' HG22 ' A' ' 63' ' ' VAL . 2.4 t80 -58.96 -43.91 91.38 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.207 -1.558 . . . . 0.0 109.395 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.426 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 89.7 mtp -51.52 -56.84 11.16 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.505 -0.747 . . . . 0.0 111.372 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -72.78 -52.67 14.06 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.767 -1.208 . . . . 0.0 112.701 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -85.14 -50.37 7.47 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -174.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.58 -5.02 40.13 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.126 -1.609 . . . . 0.0 114.109 -175.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.9 t80 -60.12 -38.56 60.51 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 119.687 -1.883 . . . . 0.0 109.62 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.7 Cg_exo -65.64 -54.79 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.421 2.081 . . . . 0.0 112.6 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.78 -39.55 81.4 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.367 -0.833 . . . . 0.0 109.137 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.401 ' OE1' ' N ' ' A' ' 111' ' ' CYS . 0.4 OUTLIER -73.12 -51.16 18.99 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.455 -0.778 . . . . 0.0 110.287 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -71.42 -43.02 67.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.403 -0.81 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.93 -51.09 59.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.863 -1.148 . . . . 0.0 111.033 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -74.71 -27.88 60.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.146 -0.971 . . . . 0.0 111.691 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -123.26 -30.31 3.72 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.911 -1.118 . . . . 0.0 111.298 -177.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 111' ' ' CYS . 40.0 t30 57.41 45.95 19.01 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.819 -1.176 . . . . 0.0 110.12 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.03 -31.72 72.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.174 -0.954 . . . . 0.0 110.894 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.2 t -154.39 -166.97 2.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.94 -1.1 . . . . 0.0 111.316 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.508 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.0 p -127.79 158.46 70.27 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.646 -0.659 . . . . 0.0 109.98 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -55.87 -41.32 78.43 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 121.651 1.567 . . . . 0.0 112.256 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.31 90.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.849 -1.157 . . . . 0.0 109.668 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.446 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.3 mt-10 -66.07 -42.4 89.47 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 27.9 tp -68.49 -52.71 29.31 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.71 -0.619 . . . . 0.0 110.173 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -58.26 -46.41 86.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.382 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.48 -42.23 98.47 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -0.854 . . . . 0.0 110.162 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.72 -33.62 75.24 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.533 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 11.1 mt -65.9 -46.49 88.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -64.73 -37.76 88.68 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.982 -1.074 . . . . 0.0 109.391 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.37 -29.86 75.61 Favored Glycine 0 N--CA 1.492 2.397 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.033 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.778 HD22 ' NH1' ' A' ' 99' ' ' ARG . 33.9 p-10 -92.0 -31.43 15.6 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.863 -1.374 . . . . 0.0 111.424 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.651 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 76.3 mtm180 -62.51 146.74 50.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.516 -1.365 . . . . 0.0 110.237 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.565 ' CG ' HH11 ' A' ' 131' ' ' ARG . 0.0 OUTLIER -62.59 147.58 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.617 -0.677 . . . . 0.0 109.672 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -64.8 -17.76 64.5 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.201 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.854 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.415 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.846 0 O4'-C1'-C2' 108.0 1.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.527 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.126 0 O4'-C1'-C2' 108.585 2.259 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.991 0 O4'-C4'-C3' 107.483 1.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.336 0 O5'-C5'-C4' 113.368 2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O5'-C5'-C4' 112.884 1.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.523 0 O5'-C5'-C4' 113.254 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.052 0 O5'-C5'-C4' 113.115 2.082 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.534 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.26 0 O4'-C1'-C2' 108.453 2.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.071 0 O5'-C5'-C4' 113.147 2.105 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.41 0 O4'-C1'-C2' 108.583 2.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.77 0 O4'-C4'-C3' 107.648 2.048 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.876 0 O4'-C4'-C3' 107.946 2.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.89 0 O4'-C4'-C3' 107.849 2.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 O4'-C4'-C3' 107.501 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.159 0 O4'-C4'-C3' 107.999 2.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.437 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.42 -2.333 0 O4'-C1'-C2' 107.717 1.47 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.437 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O4'-C4'-C3' 107.895 2.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O5'-C5'-C4' 112.519 1.656 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.57 0 O5'-C5'-C4' 113.739 2.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.633 0 O4'-C4'-C3' 107.934 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.6 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.779 0 O5'-C5'-C4' 112.834 1.882 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.6 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.021 0 O5'-C5'-C4' 113.638 2.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.996 0 O5'-C5'-C4' 113.54 2.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.929 0 O4'-C1'-C2' 108.858 2.508 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.25 0 O4'-C4'-C3' 108.053 2.453 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O4'-C4'-C3' 107.658 2.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.47 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.766 0 O4'-C4'-C3' 107.633 2.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O5'-C5'-C4' 112.996 1.997 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.056 0 O4'-C4'-C3' 107.501 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -114.21 84.56 2.07 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.367 -1.078 . . . . 0.0 109.238 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -112.04 139.65 47.38 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.383 -0.823 . . . . 0.0 109.261 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -54.96 -37.22 66.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -0.902 . . . . 0.0 109.946 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.02 -42.2 98.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.966 -1.084 . . . . 0.0 109.504 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -58.33 -34.31 70.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.395 -0.815 . . . . 0.0 109.829 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 36.0 mm-40 -70.6 -54.28 12.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.228 -0.92 . . . . 0.0 110.849 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -49.2 -46.67 45.96 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.724 -1.235 . . . . 0.0 109.252 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -61.18 -40.73 95.01 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.43 -0.794 . . . . 0.0 109.532 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.49 -53.17 25.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.323 -0.861 . . . . 0.0 111.404 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -36.14 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 120.803 -1.186 . . . . 0.0 109.279 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -58.74 -38.44 78.39 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.301 -1.499 . . . . 0.0 108.03 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -59.41 -31.71 69.51 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.218 -0.926 . . . . 0.0 108.655 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mt -67.09 -40.37 86.96 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.31 -0.869 . . . . 0.0 111.166 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 83.3 m-85 -74.9 -35.59 62.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.487 -1.383 . . . . 0.0 109.595 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.483 ' O ' ' C ' ' A' ' 19' ' ' ILE . 99.1 mt-10 -64.43 -29.9 70.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.627 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.483 ' C ' ' O ' ' A' ' 18' ' ' GLU . 24.2 mt -37.4 -41.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.607 -0.683 . . . . 0.0 110.702 -178.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -171.56 163.33 6.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.716 -1.24 . . . . 0.0 110.891 -178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -90.3 69.91 7.08 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.462 0.649 . . . . 0.0 109.596 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.01 94.93 27.24 Favored Pre-proline 0 N--CA 1.489 1.523 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -46.69 -44.44 21.7 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 122.166 1.911 . . . . 0.0 112.024 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -63.43 -40.37 96.97 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.179 -0.95 . . . . 0.0 108.615 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.433 -0.792 . . . . 0.0 109.803 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.0 -49.04 79.24 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.16 -0.963 . . . . 0.0 108.686 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -53.61 -38.25 63.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.463 -0.773 . . . . 0.0 109.385 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -64.03 -59.84 3.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.465 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.401 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 28.4 mt -56.45 -45.54 80.77 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.124 -0.985 . . . . 0.0 108.657 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.511 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 40.8 m-20 -60.15 -47.95 83.79 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.567 -0.853 . . . . 0.0 108.843 179.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -66.41 -43.49 85.6 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.484 -0.76 . . . . 0.0 109.889 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 tp -58.64 -49.75 76.37 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.211 -0.931 . . . . 0.0 110.306 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 49.4 m-85 -59.92 -36.93 78.07 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.953 -1.499 . . . . 0.0 107.792 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.422 ' O ' ' NZ ' ' A' ' 38' ' ' LYS . 36.4 m -69.71 -49.86 49.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.363 -0.836 . . . . 0.0 109.813 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 72.9 t80 -59.12 -46.21 88.92 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.302 -0.874 . . . . 0.0 111.123 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 95.4 mtp -57.36 -34.76 69.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.75 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -55.6 -34.99 65.35 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.647 -1.283 . . . . 0.0 108.784 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.422 ' NZ ' ' O ' ' A' ' 34' ' ' SER . 14.5 mmtm -74.75 -34.71 62.57 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.406 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 25.3 mmm180 -66.25 -30.97 71.51 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.028 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.23 0.17 63.5 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.0 p -115.25 85.18 12.39 Favored Pre-proline 0 N--CA 1.486 1.35 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.94 140.56 14.42 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 121.94 1.76 . . . . 0.0 110.513 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 29.8 mt -70.47 92.03 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 120.936 -1.103 . . . . 0.0 110.591 -177.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 21.7 m120 -58.9 -30.1 67.54 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -167.17 140.08 3.49 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.69 144.13 90.65 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.857 -1.152 . . . . 0.0 110.237 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.41 134.22 18.6 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.516 1.477 . . . . 0.0 108.369 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.6 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 56.6 mt -103.18 142.51 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 110.842 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.406 ' N ' HG21 ' A' ' 48' ' ' ILE . 82.2 mtp -136.24 123.95 22.44 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.04 39.97 4.2 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt 57.57 22.39 8.12 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.273 0.558 . . . . 0.0 110.119 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.3 m -134.38 151.16 51.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.257 -0.902 . . . . 0.0 109.22 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.56 143.46 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 120.774 -1.204 . . . . 0.0 108.708 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.3 tp -74.58 123.02 24.04 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.258 -0.901 . . . . 0.0 109.468 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -56.41 105.28 0.19 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.72 -30.57 71.58 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -80.21 -64.96 1.07 Allowed 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.238 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -52.95 -39.82 63.2 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 120.623 -1.298 . . . . 0.0 108.755 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.8 -48.7 74.92 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.403 ' CZ ' HD13 ' A' ' 64' ' ' ILE . 53.2 t80 -62.75 -66.8 0.49 Allowed 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.442 0.639 . . . . 0.0 109.913 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -43.06 -40.51 3.16 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.459 -0.776 . . . . 0.0 110.905 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.432 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -72.66 -47.07 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 117.897 -1.521 . . . . 0.0 107.836 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.421 HG21 ' CE2' ' A' ' 102' ' ' TYR . 26.6 t -55.34 -42.65 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.954 . . . . 0.0 109.987 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.441 HG22 HD12 ' A' ' 64' ' ' ILE . 13.0 mm -68.41 -35.67 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 120.504 -1.372 . . . . 0.0 107.715 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.85 -17.39 23.42 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.961 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.654 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.9 mmt-85 -96.99 5.3 50.7 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.524 -1.36 . . . . 0.0 108.986 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.6 11.24 82.14 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.646 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.99 134.56 3.29 Favored Glycine 0 N--CA 1.5 2.95 0 CA-C-N 119.252 1.526 . . . . 0.0 111.413 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 tp -48.55 -42.67 34.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.708 -0.877 . . . . 0.0 110.832 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.456 ' CG2' ' HG ' ' A' ' 117' ' ' SER . 95.1 t -58.11 -40.64 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.0 110.005 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -58.59 -40.36 82.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.002 . . . . 0.0 110.034 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.581 ' O ' ' N ' ' A' ' 76' ' ' LYS . 40.3 t -64.55 -47.01 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.264 -0.897 . . . . 0.0 110.639 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.08 -56.68 16.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.814 -1.179 . . . . 0.0 109.894 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.434 ' OD1' ' CB ' ' A' ' 125' ' ' ALA . 86.7 m-20 -59.56 -43.69 93.49 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.284 -0.885 . . . . 0.0 111.568 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -94.05 -4.46 49.41 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.909 -1.119 . . . . 0.0 110.685 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.636 ' HZ2' " C5'" ' C' ' 419' ' ' ' DC' . 51.0 mttm 59.24 56.74 3.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.595 -0.691 . . . . 0.0 111.135 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.6 mt -90.51 13.84 14.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.561 -1.256 . . . . 0.0 107.941 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' ILE . 96.9 m95 -63.49 -41.41 98.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.43 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.9 mt-30 -47.86 -39.92 19.98 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 120.809 -1.182 . . . . 0.0 108.011 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.654 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.3 mt-10 -67.33 -38.54 85.07 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.463 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.0 mt -74.78 -51.91 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.37 -0.831 . . . . 0.0 108.987 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 78' ' ' TRP . 60.8 mt -50.58 -51.47 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -74.65 -37.4 62.76 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.592 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.44 -32.92 46.18 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 83.2 mt -91.17 -7.31 51.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.38 -1.071 . . . . 0.0 109.255 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 65.03 40.59 5.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.777 -0.577 . . . . 0.0 110.106 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.3 mt -72.5 136.83 80.82 Favored Pre-proline 0 N--CA 1.488 1.467 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.561 ' C ' ' H ' ' A' ' 90' ' ' SER . 35.7 Cg_endo -68.54 144.23 60.06 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.891 1.727 . . . . 0.0 112.48 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.0 p -58.19 0.66 0.06 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.265 -0.897 . . . . 0.0 109.654 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.561 ' H ' ' C ' ' A' ' 88' ' ' PRO . 18.0 m -64.07 -35.31 80.32 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.138 -0.976 . . . . 0.0 109.301 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.401 HG23 HD12 ' A' ' 91' ' ' ILE . 89.5 mt -90.07 97.41 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.939 -1.101 . . . . 0.0 108.54 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 68.7 p -66.62 -27.86 68.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.873 . . . . 0.0 109.813 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.8 m -102.46 47.77 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.169 -0.957 . . . . 0.0 109.512 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.71 -59.43 3.58 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.169 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.83 -51.14 23.91 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.287 -0.883 . . . . 0.0 109.879 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.4 -44.29 88.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.748 -1.22 . . . . 0.0 109.039 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.3 m -60.81 -40.46 92.78 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.152 -0.968 . . . . 0.0 108.694 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.5 mt -71.18 -44.28 65.76 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.483 -0.761 . . . . 0.0 109.941 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.752 HH12 HD22 ' A' ' 129' ' ' ASN . 40.9 ttp180 -66.5 -53.1 38.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.24 -0.912 . . . . 0.0 110.947 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -56.59 -52.28 65.42 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.473 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -62.46 -40.08 95.46 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.046 -1.034 . . . . 0.0 110.978 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.421 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.7 t80 -57.08 -41.0 78.02 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.382 -1.449 . . . . 0.0 109.2 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.427 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.3 ttm -54.65 -54.72 37.89 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.463 -0.773 . . . . 0.0 111.396 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.8 mttt -72.65 -50.54 24.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.564 -1.335 . . . . 0.0 113.098 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.405 ' CD1' ' N ' ' A' ' 105' ' ' TYR . 34.3 m-85 -84.8 -52.86 5.74 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -174.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.0 mp -100.44 12.65 36.76 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.222 -1.549 . . . . 0.0 114.391 -175.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.525 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 62.7 t80 -67.37 -38.65 16.6 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 119.796 -1.815 . . . . 0.0 111.815 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.1 Cg_endo -78.05 -40.09 0.41 Allowed 'Trans proline' 0 N--CA 1.49 1.302 0 C-N-CA 121.475 1.45 . . . . 0.0 112.834 -178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.14 -42.97 87.04 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -68.96 -51.89 34.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.634 -0.666 . . . . 0.0 110.256 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.526 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.7 m -71.45 -43.69 66.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.376 -0.827 . . . . 0.0 110.932 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 46.4 tp10 -66.72 -50.26 63.38 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.086 -1.009 . . . . 0.0 111.223 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -75.83 -26.54 57.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.021 -1.049 . . . . 0.0 111.402 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.1 tptt -125.33 -30.46 3.14 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.043 -1.036 . . . . 0.0 111.82 -177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.3 OUTLIER 59.66 45.11 13.46 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.737 -1.227 . . . . 0.0 110.206 179.672 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 84.6 mt -69.57 -32.15 70.76 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.136 -0.978 . . . . 0.0 111.288 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 118' ' ' THR . 32.0 t -153.12 -167.04 2.6 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.515 -1.274 . . . . 0.0 112.064 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.531 ' N ' ' OG ' ' A' ' 117' ' ' SER . 40.1 p -129.81 155.26 80.75 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 121.835 -0.541 . . . . 0.0 109.695 -178.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.01 -40.63 80.4 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.112 1.875 . . . . 0.0 112.122 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.79 88.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.821 -1.174 . . . . 0.0 109.254 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.484 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.9 mt-10 -66.67 -45.25 79.53 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 34.6 tp -65.97 -51.77 55.5 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -57.26 -47.34 81.67 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.234 -0.916 . . . . 0.0 109.533 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.84 90.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.402 -0.811 . . . . 0.0 109.873 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.434 ' CB ' ' OD1' ' A' ' 74' ' ' ASN . . . -68.46 -36.09 78.51 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.055 0.931 . . . . 0.0 108.547 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.44 HD12 HG22 ' A' ' 126' ' ' ILE . 34.1 mt -65.59 -48.33 83.05 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.031 0 CA-C-O 121.521 0.677 . . . . 0.0 109.191 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -64.19 -37.22 86.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.406 -0.809 . . . . 0.0 109.095 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.6 -36.01 92.62 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.752 HD22 HH12 ' A' ' 99' ' ' ARG . 0.1 OUTLIER -93.87 -36.0 12.43 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.115 -1.226 . . . . 0.0 110.63 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.662 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 57.4 mtp180 -66.75 148.93 51.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.677 -1.264 . . . . 0.0 109.778 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.63 171.34 0.32 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.283 -0.886 . . . . 0.0 108.982 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -110.74 -156.59 0.59 Allowed 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.464 -0.772 . . . . 0.0 109.019 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 179.99 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O4'-C1'-C2' 108.244 1.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.632 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.906 0 O4'-C1'-C2' 108.805 2.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.108 0 O4'-C4'-C3' 107.38 1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.233 0 O5'-C5'-C4' 113.317 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O5'-C5'-C4' 113.008 2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.962 0 O5'-C5'-C4' 113.219 2.156 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.875 0 O5'-C5'-C4' 112.851 1.893 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.6 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.522 1.406 0 O4'-C1'-C2' 108.404 2.095 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . 0.533 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.337 0 O5'-C5'-C4' 113.209 2.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.292 0 O4'-C4'-C3' 107.842 2.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O5'-C5'-C4' 113.154 2.11 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . 0.429 ' N2 ' ' C2 ' ' C' ' 420' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.405 0 O5'-C5'-C4' 113.45 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.16 0 O4'-C4'-C3' 107.994 2.394 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.921 0 O4'-C4'-C3' 107.663 2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.162 0 O4'-C4'-C3' 108.026 2.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.826 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C1'-C2' 109.051 2.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.59 0 O4'-C1'-C2' 108.811 2.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.371 0 O5'-C5'-C4' 112.698 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.636 " C5'" ' HZ2' ' A' ' 76' ' ' LYS . . . . . . . . 0 P--O5' 1.609 1.557 0 O5'-C5'-C4' 113.892 2.637 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.515 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 P--O5' 1.61 1.713 0 O5'-C5'-C4' 113.335 2.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.533 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.033 0 O5'-C5'-C4' 113.054 2.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.533 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O5'-C5'-C4' 113.625 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.902 0 O5'-C5'-C4' 113.377 2.269 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.298 0 O4'-C1'-C2' 108.772 2.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.018 0 O4'-C4'-C3' 107.868 2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.424 0 O4'-C4'-C3' 107.394 1.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.758 0 O4'-C4'-C3' 107.84 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.882 0 O4'-C4'-C3' 107.605 2.005 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 113.101 2.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.782 0 O4'-C4'-C3' 107.595 1.995 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -111.61 87.24 2.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.364 -1.08 . . . . 0.0 109.47 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.82 138.15 51.1 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.307 -0.871 . . . . 0.0 109.833 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -56.74 -37.58 71.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.553 -0.717 . . . . 0.0 110.48 -178.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.38 -42.85 95.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.838 -1.164 . . . . 0.0 109.267 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -54.83 -45.38 74.44 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.238 -0.914 . . . . 0.0 109.138 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -67.28 -37.38 83.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 108.95 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -53.55 -48.52 69.03 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.308 -0.87 . . . . 0.0 109.471 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -62.45 -38.97 91.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.101 -0.999 . . . . 0.0 109.204 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.31 -48.74 72.04 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.77 . . . . 0.0 110.386 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -74.06 -34.67 39.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 O-C-N 120.761 -1.212 . . . . 0.0 108.218 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -54.65 -40.6 69.18 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -59.49 -31.08 69.03 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 11.7 mt -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.829 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.499 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -81.54 -32.24 32.36 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.536 -1.352 . . . . 0.0 110.458 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.6 mt-10 -67.73 -31.02 70.67 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.827 -1.171 . . . . 0.0 110.432 -178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.486 ' C ' ' O ' ' A' ' 18' ' ' GLU . 14.6 mt -35.28 -39.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.784 -0.572 . . . . 0.0 110.556 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.573 ' ND2' ' OD1' ' A' ' 22' ' ' ASP . 41.3 p-10 -173.72 167.06 4.5 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.97 -1.081 . . . . 0.0 110.034 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -94.22 64.75 3.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.624 -0.673 . . . . 0.0 109.821 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.573 ' OD1' ' ND2' ' A' ' 20' ' ' ASN . 1.7 m-20 -96.33 141.4 23.06 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.061 -1.024 . . . . 0.0 108.811 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.48 -61.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.14 1.893 . . . . 0.0 112.329 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -60.81 -34.09 74.01 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.858 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.667 ' CG ' HH11 ' A' ' 25' ' ' ARG . 0.8 OUTLIER -55.53 -44.95 77.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.98 -1.075 . . . . 0.0 109.954 -179.109 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -61.89 -54.71 38.28 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.04 -1.037 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.05 -37.91 61.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 108.872 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -61.37 -62.81 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.396 -0.815 . . . . 0.0 109.392 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 69.2 mt -54.17 -47.74 71.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.538 -0.726 . . . . 0.0 109.684 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 98.9 m-20 -61.31 -49.26 77.72 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.197 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -66.63 -42.3 86.99 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.998 -1.064 . . . . 0.0 109.635 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.67 -52.53 65.06 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.271 -0.893 . . . . 0.0 110.356 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -60.54 -34.34 73.99 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.984 -1.486 . . . . 0.0 107.74 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.3 m -69.29 -53.43 19.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.372 -0.83 . . . . 0.0 109.51 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 72.2 t80 -59.51 -40.13 86.07 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.568 -0.707 . . . . 0.0 110.57 -179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 75.3 mmm -58.96 -37.8 77.61 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.333 -0.854 . . . . 0.0 110.83 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.93 -39.41 94.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.909 -1.119 . . . . 0.0 110.286 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -69.47 -30.58 68.5 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.91 -1.119 . . . . 0.0 108.358 179.417 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.405 ' N ' ' HG3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -67.27 -30.58 70.49 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.76 -2.21 58.47 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 107.389 -2.284 . . . . 0.0 107.389 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 75.2 p -118.86 84.41 25.6 Favored Pre-proline 0 N--CA 1.491 1.597 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -83.02 137.15 8.4 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.561 2.174 . . . . 0.0 111.082 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.9 mt -73.98 97.73 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.038 -1.038 . . . . 0.0 109.94 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -65.41 -43.68 89.81 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.555 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.33 133.4 38.78 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mt -70.33 146.64 94.6 Favored Pre-proline 0 C--N 1.298 -1.65 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.528 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -67.08 127.29 16.54 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 121.209 1.273 . . . . 0.0 109.186 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.569 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.0 mt -96.11 143.67 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.848 -1.158 . . . . 0.0 109.763 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 57.3 mmm -140.54 123.35 16.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.669 0.747 . . . . 0.0 108.991 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.4 41.42 3.27 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.1 mttt 57.93 23.32 9.7 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.45 0.643 . . . . 0.0 109.89 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 89.7 p -136.98 155.62 49.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 108.936 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.28 148.42 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.972 -1.08 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.5 tp -81.66 122.91 28.22 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.685 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -65.17 89.43 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 0.0 109.07 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.5 mt -56.06 -23.54 34.13 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 120.786 -1.196 . . . . 0.0 109.168 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -78.43 -56.21 4.62 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.36 -0.838 . . . . 0.0 111.437 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.81 -39.33 91.35 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.815 -1.178 . . . . 0.0 110.132 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.7 -44.28 93.75 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.083 -1.011 . . . . 0.0 108.286 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.404 ' CZ ' HD12 ' A' ' 64' ' ' ILE . 52.9 t80 -56.21 -67.17 0.32 Allowed 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -43.17 -39.16 2.75 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 111.138 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.579 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 7.8 mt -70.66 -44.36 67.25 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 118.057 -1.457 . . . . 0.0 107.562 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG21 ' CE2' ' A' ' 102' ' ' TYR . 48.6 t -59.44 -45.05 93.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.264 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.404 HD12 ' CZ ' ' A' ' 60' ' ' TYR . 6.0 mm -68.22 -34.8 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.637 -1.289 . . . . 0.0 108.367 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.58 -26.95 35.52 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.774 -0.578 . . . . 0.0 110.358 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.614 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.9 mpt_? -90.74 -0.55 57.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.441 -1.412 . . . . 0.0 108.914 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.54 19.74 61.44 Favored Glycine 0 N--CA 1.489 2.221 0 C-N-CA 120.386 -0.912 . . . . 0.0 111.808 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 138.44 131.9 2.93 Favored Glycine 0 N--CA 1.499 2.838 0 O-C-N 120.672 -1.487 . . . . 0.0 111.418 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.65 -39.54 36.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.617 -0.931 . . . . 0.0 109.914 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 83.4 t -58.29 -43.22 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.212 -0.93 . . . . 0.0 109.907 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -54.99 -39.37 68.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.725 -1.234 . . . . 0.0 109.045 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.599 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.0 t -63.37 -42.11 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.49 -0.756 . . . . 0.0 109.845 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.439 HG12 HH11 ' A' ' 99' ' ' ARG . 72.7 mt -66.61 -58.52 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.661 -1.274 . . . . 0.0 110.454 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -56.64 -42.47 78.97 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.36 -9.46 38.73 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.22 -0.925 . . . . 0.0 110.826 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 72' ' ' VAL . 40.3 mttp 58.17 60.81 2.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.211 -0.93 . . . . 0.0 110.292 -178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.7 mt -93.23 16.24 13.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.017 -1.052 . . . . 0.0 108.497 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 82.3 m95 -64.78 -39.07 93.01 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.424 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.1 mm-40 -49.54 -38.28 30.28 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 118.425 -1.31 . . . . 0.0 108.093 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.614 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -69.26 -40.57 77.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 mt -71.75 -53.33 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.431 -0.793 . . . . 0.0 109.062 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.485 ' N ' ' O ' ' A' ' 78' ' ' TRP . 77.1 mt -51.48 -53.7 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 109.19 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -68.94 -39.15 79.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.223 -0.923 . . . . 0.0 110.201 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.7 -32.63 47.5 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.458 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 1.1 mm? -89.18 -7.95 54.61 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.385 -1.068 . . . . 0.0 108.7 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 63.96 42.34 5.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.837 -0.54 . . . . 0.0 110.331 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 142.16 83.62 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.201 -0.937 . . . . 0.0 108.934 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.601 ' C ' ' H ' ' A' ' 90' ' ' SER . 36.5 Cg_endo -69.86 143.2 49.59 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 C-N-CA 122.063 1.842 . . . . 0.0 112.456 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.7 p -55.61 -1.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.414 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 88' ' ' PRO . 23.3 m -64.43 -34.19 77.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 110.154 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 91' ' ' ILE . 80.0 mt -90.99 97.5 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 120.738 -1.226 . . . . 0.0 109.243 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 69.1 p -70.45 -21.92 62.75 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.284 -0.885 . . . . 0.0 109.194 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 57.9 m -104.25 43.37 1.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.467 -0.771 . . . . 0.0 109.159 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.39 -61.19 2.26 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.331 -0.856 . . . . 0.0 109.319 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.4 -50.47 30.8 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 109.807 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.7 tp -58.02 -46.06 85.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.765 -1.209 . . . . 0.0 109.116 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.2 m -58.92 -41.08 86.44 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.047 -1.033 . . . . 0.0 108.319 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.19 -44.46 68.66 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.802 . . . . 0.0 109.507 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.467 ' HG3' HH11 ' A' ' 99' ' ' ARG . 6.7 ttm-85 -65.81 -55.04 19.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.981 -1.074 . . . . 0.0 111.017 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.4 m -57.22 -52.9 63.46 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.436 -0.79 . . . . 0.0 111.003 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.66 -43.79 97.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.071 -1.018 . . . . 0.0 111.715 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.414 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.1 t80 -57.69 -39.65 77.66 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.356 -1.465 . . . . 0.0 109.595 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -54.46 -54.72 37.12 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.28 -0.888 . . . . 0.0 111.65 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -72.87 -52.88 13.03 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.477 -1.389 . . . . 0.0 113.198 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -84.68 -50.33 7.73 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 9.2 mp -97.2 6.23 48.78 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.235 -1.541 . . . . 0.0 113.863 -176.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.596 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 68.8 t80 -67.74 -37.01 10.85 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 119.955 -1.716 . . . . 0.0 111.684 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.558 ' O ' ' N ' ' A' ' 112' ' ' GLU . 60.6 Cg_endo -78.75 -40.98 0.26 Allowed 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 121.354 1.369 . . . . 0.0 112.096 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.54 -42.97 89.07 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -70.86 -46.04 63.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.599 -0.688 . . . . 0.0 110.072 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.1 t -77.03 -45.81 25.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.337 -0.852 . . . . 0.0 110.611 -178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.5 tp10 -66.22 -47.13 74.82 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.099 -1.001 . . . . 0.0 110.856 -178.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -76.61 -33.63 58.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.095 -1.003 . . . . 0.0 111.417 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -119.6 -27.43 5.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 111.783 -177.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 111' ' ' CYS . 24.1 t-20 55.76 45.34 24.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.78 -1.2 . . . . 0.0 110.389 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.1 mt -67.24 -31.34 71.63 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.176 -0.952 . . . . 0.0 110.966 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.521 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.5 t -154.65 -167.0 2.47 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 118.746 -1.182 . . . . 0.0 111.576 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.521 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.6 p -122.06 152.67 60.34 Favored Pre-proline 0 N--CA 1.497 1.907 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.596 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 10.9 Cg_endo -55.85 -38.76 94.09 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.883 1.722 . . . . 0.0 112.092 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.95 -37.71 88.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.98 -1.075 . . . . 0.0 109.539 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.467 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.7 mt-10 -66.96 -43.42 83.15 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.414 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 15.6 tp -64.31 -52.92 56.11 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.536 -0.728 . . . . 0.0 109.657 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -58.62 -47.25 84.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.331 -0.855 . . . . 0.0 109.794 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.12 -38.68 87.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 110.033 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.84 -34.04 76.92 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.543 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -68.42 -45.61 81.93 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 N-CA-C 108.102 -1.074 . . . . 0.0 108.102 177.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.437 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 62.5 t0 -58.94 -40.05 83.47 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.046 -1.034 . . . . 0.0 108.799 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.14 -26.83 73.73 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 17.5 p-10 -89.49 -31.82 17.49 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.766 -1.432 . . . . 0.0 110.595 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.652 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 85.5 mtm180 -62.85 142.06 58.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.662 -1.273 . . . . 0.0 110.083 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -67.14 147.97 52.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.813 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -76.11 -4.23 40.39 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.986 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.955 0 O4'-C1'-C2' 108.406 2.096 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.102 0 O4'-C4'-C3' 107.757 2.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.848 0 O4'-C4'-C3' 107.602 2.002 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.086 0 O4'-C4'-C3' 107.863 2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O5'-C5'-C4' 112.809 1.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.939 0 O5'-C5'-C4' 113.011 2.008 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.852 0 O5'-C5'-C4' 112.927 1.948 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.569 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.182 0 O4'-C4'-C3' 107.807 2.207 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.281 0 O5'-C5'-C4' 113.105 2.075 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O4'-C4'-C3' 107.793 2.193 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.994 0 O5'-C5'-C4' 113.137 2.098 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.246 2.176 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.095 0 O4'-C4'-C3' 108.146 2.546 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.834 0 O4'-C4'-C3' 107.454 1.854 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.978 0 O4'-C4'-C3' 107.885 2.285 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.83 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.972 0 O4'-C1'-C2' 109.002 2.638 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.599 0 C4'-C3'-C2' 105.733 2.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O5'-C5'-C4' 112.784 1.846 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.448 0 O5'-C5'-C4' 113.7 2.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.422 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.425 -1.927 0 O4'-C4'-C3' 107.913 2.313 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O5'-C5'-C4' 113.1 2.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O5'-C5'-C4' 113.547 2.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 113.372 2.266 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.321 0 O4'-C1'-C2' 108.663 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.272 0 O4'-C4'-C3' 107.533 1.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 0 O5'-C5'-C4' 113.226 2.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.026 0 O5'-C5'-C4' 113.058 2.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.068 0 O4'-C4'-C3' 107.806 2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.096 0 C1'-O4'-C4' 106.282 -2.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.584 ' O ' ' N ' ' A' ' 5' ' ' SER . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.445 ' C ' ' O ' ' A' ' 3' ' ' GLY . 26.5 t90 -37.86 90.61 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.665 -0.903 . . . . 0.0 110.125 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.584 ' N ' ' O ' ' A' ' 3' ' ' GLY . 0.1 OUTLIER -107.13 135.74 48.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.267 -0.896 . . . . 0.0 109.29 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -58.59 -40.76 84.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.516 -0.74 . . . . 0.0 111.104 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.26 -42.39 98.55 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.917 -1.114 . . . . 0.0 109.898 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -50.56 -35.15 28.45 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.365 -0.835 . . . . 0.0 110.025 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.608 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 36.2 mt-30 -69.86 -41.58 74.65 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.922 -1.111 . . . . 0.0 111.116 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -54.24 -49.54 69.24 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.694 -1.254 . . . . 0.0 110.052 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.02 -42.32 99.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.068 -1.02 . . . . 0.0 109.453 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.04 -47.27 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.261 -0.899 . . . . 0.0 110.891 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 16' ' ' LEU . 2.7 m -72.67 -36.7 53.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 120.58 -1.325 . . . . 0.0 108.8 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -53.49 -40.44 65.36 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -59.45 -31.3 69.18 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 13' ' ' VAL . 10.9 mt -72.91 -36.33 67.24 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.462 -0.773 . . . . 0.0 111.633 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.485 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -79.05 -33.38 44.76 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.318 -1.489 . . . . 0.0 110.769 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.5 mm-40 -67.18 -26.35 66.6 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.888 -1.132 . . . . 0.0 110.528 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.474 ' C ' ' O ' ' A' ' 18' ' ' GLU . 28.7 mt -37.79 -39.55 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.617 -0.677 . . . . 0.0 110.694 -178.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -171.65 163.76 6.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.752 -1.218 . . . . 0.0 110.321 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -90.0 65.18 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.696 -0.627 . . . . 0.0 110.213 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -112.44 95.87 33.52 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.464 -0.773 . . . . 0.0 108.976 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.61 -40.16 30.2 Favored 'Trans proline' 0 N--CA 1.493 1.441 0 C-N-CA 122.358 2.038 . . . . 0.0 112.272 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -60.91 -41.1 95.46 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.02 -1.05 . . . . 0.0 108.592 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.651 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -59.79 -39.02 83.55 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.485 -0.76 . . . . 0.0 109.416 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.578 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 57.7 tttm -59.94 -50.58 73.2 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.16 -39.17 63.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.401 ' O ' ' N ' ' A' ' 32' ' ' LEU . 62.2 t80 -63.42 -61.86 2.06 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.486 -0.759 . . . . 0.0 109.539 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 74.7 mt -56.14 -46.73 79.13 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.345 -0.847 . . . . 0.0 109.067 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.578 ' OD2' ' NZ ' ' A' ' 26' ' ' LYS . 70.3 m-20 -62.29 -52.14 64.91 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.702 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.81 -40.87 92.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.244 -0.91 . . . . 0.0 109.188 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 28' ' ' PHE . 60.1 tp -57.23 -55.69 31.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.334 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.9 m-85 -60.63 -34.05 73.69 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.08 -1.448 . . . . 0.0 107.979 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -69.96 -52.95 20.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.514 -0.741 . . . . 0.0 110.614 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.415 ' CE1' ' NZ ' ' A' ' 113' ' ' LYS . 78.9 t80 -60.19 -43.57 95.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 111.908 -178.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 98.1 mtp -57.86 -34.36 69.67 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.095 -1.003 . . . . 0.0 111.123 -178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -54.12 -40.18 67.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.622 -1.299 . . . . 0.0 108.169 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -67.21 -37.53 83.78 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.469 -0.769 . . . . 0.0 109.358 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -63.5 -31.66 72.88 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.729 -0.607 . . . . 0.0 109.602 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.41 -2.96 61.2 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 108.238 -1.945 . . . . 0.0 108.238 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 39.6 p -118.99 85.18 28.41 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -83.49 144.6 11.48 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.58 2.187 . . . . 0.0 111.666 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.608 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 8.9 mt -77.13 94.07 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.109 -0.995 . . . . 0.0 109.264 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -61.0 -35.33 76.57 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.608 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -148.44 136.04 20.61 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 mt -71.45 145.49 90.43 Favored Pre-proline 0 C--N 1.297 -1.692 0 O-C-N 120.987 -1.071 . . . . 0.0 109.003 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -67.39 133.69 31.05 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 N-CA-C 108.982 -1.199 . . . . 0.0 108.982 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.512 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 5.7 mt -101.59 145.51 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.887 -1.133 . . . . 0.0 109.945 -178.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.475 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 81.3 mtp -144.67 118.74 9.42 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 73.15 37.98 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mttt 57.79 25.15 11.59 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.639 0.733 . . . . 0.0 109.29 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 93.3 p -136.85 154.87 50.39 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.3 m -68.04 145.32 13.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.176 -0.953 . . . . 0.0 109.076 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 49.8 tp -77.92 123.61 27.0 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.306 -0.872 . . . . 0.0 109.512 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -62.89 88.51 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.8 mt -53.96 -25.43 20.65 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.87 -1.144 . . . . 0.0 108.957 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.502 ' HH ' HD22 ' A' ' 61' ' ' ASN . 43.9 t80 -78.86 -52.69 7.97 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.342 -0.849 . . . . 0.0 111.984 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -64.38 -37.34 87.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.556 -1.34 . . . . 0.0 110.165 -178.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.4 tp -58.79 -44.03 90.62 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.531 ' CE1' ' CD1' ' A' ' 64' ' ' ILE . 56.6 t80 -56.36 -73.66 0.06 Allowed 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.502 HD22 ' HH ' ' A' ' 57' ' ' TYR . 89.8 m-20 -39.36 -41.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.257 -0.902 . . . . 0.0 111.782 -177.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mt -71.46 -44.48 64.71 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 117.943 -1.503 . . . . 0.0 107.945 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.408 HG11 ' CZ ' ' A' ' 102' ' ' TYR . 19.1 t -59.34 -46.69 92.3 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.164 179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.531 ' CD1' ' CE1' ' A' ' 60' ' ' TYR . 5.5 mm -68.99 -35.59 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.769 -1.207 . . . . 0.0 107.843 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.57 -23.0 9.5 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.628 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.497 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.4 mpt_? -92.26 -1.94 56.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.648 -1.283 . . . . 0.0 108.782 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.48 19.47 64.07 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.166 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.07 127.54 2.23 Favored Glycine 0 N--CA 1.5 2.929 0 CA-C-N 119.596 1.698 . . . . 0.0 111.846 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -46.91 -39.39 12.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.586 -0.95 . . . . 0.0 109.526 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.6 t -59.43 -42.1 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.223 -0.923 . . . . 0.0 109.656 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -55.01 -42.7 72.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.036 -1.04 . . . . 0.0 109.47 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 76' ' ' LYS . 22.5 t -63.28 -43.42 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.468 -0.77 . . . . 0.0 110.201 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -64.95 -56.72 14.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 O-C-N 120.813 -1.179 . . . . 0.0 110.45 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -57.38 -41.94 81.18 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -93.6 -9.91 36.45 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.029 -1.044 . . . . 0.0 110.436 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 72' ' ' VAL . 38.6 mtmt 58.73 59.96 2.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.441 -0.787 . . . . 0.0 109.772 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.3 mt -93.01 14.38 17.89 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.189 -0.945 . . . . 0.0 108.663 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.8 m95 -62.27 -39.38 92.73 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.43 ' NE2' ' OP2' ' C' ' 419' ' ' ' DC' . 87.6 mm-40 -49.08 -39.29 27.38 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.722 -1.236 . . . . 0.0 108.386 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.497 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.1 mm-40 -69.83 -39.54 76.4 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt -71.08 -54.87 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.295 -0.878 . . . . 0.0 108.881 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.485 ' N ' ' O ' ' A' ' 78' ' ' TRP . 75.1 mt -51.24 -55.61 7.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -68.41 -36.8 79.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.063 -1.023 . . . . 0.0 109.206 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.45 -34.99 49.95 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.6 mt -88.27 -7.25 57.06 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.351 -1.088 . . . . 0.0 108.667 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 66.54 40.58 3.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.236 0.541 . . . . 0.0 110.004 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.43 142.87 81.92 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.939 . . . . 0.0 108.545 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.573 ' C ' ' H ' ' A' ' 90' ' ' SER . 42.3 Cg_endo -70.34 144.28 50.46 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.142 1.895 . . . . 0.0 112.301 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 p -57.57 -0.35 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.205 -0.935 . . . . 0.0 109.486 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.573 ' H ' ' C ' ' A' ' 88' ' ' PRO . 13.8 m -65.01 -30.74 71.74 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.354 -0.841 . . . . 0.0 109.844 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.42 HG22 HD13 ' A' ' 91' ' ' ILE . 70.8 mt -93.81 97.54 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 120.656 -1.278 . . . . 0.0 109.274 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.6 p -71.87 -25.0 61.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.938 . . . . 0.0 109.345 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 m -101.88 41.77 1.19 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.64 -59.58 3.02 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.349 -0.845 . . . . 0.0 109.252 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.22 -52.6 15.44 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.152 -0.967 . . . . 0.0 109.038 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.485 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.0 tp -58.63 -44.63 90.07 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.06 -1.025 . . . . 0.0 109.214 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.3 m -60.2 -40.27 89.47 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.116 -0.99 . . . . 0.0 108.903 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.77 -46.08 69.69 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.614 -0.679 . . . . 0.0 109.786 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.52 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 37.4 ttm180 -64.94 -51.42 61.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.333 -0.854 . . . . 0.0 110.884 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -54.69 -54.75 37.69 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.671 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -62.59 -42.0 99.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 0.0 111.559 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.408 ' CZ ' HG11 ' A' ' 63' ' ' VAL . 3.2 t80 -58.02 -43.33 86.64 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 120.207 -1.558 . . . . 0.0 109.256 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.414 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 85.3 mtp -53.36 -57.43 10.62 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.734 -0.604 . . . . 0.0 112.325 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -72.82 -51.26 19.6 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.671 -1.268 . . . . 0.0 112.79 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -84.27 -47.41 10.8 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.86 -1.43 40.18 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.33 -1.481 . . . . 0.0 114.035 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.643 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 81.1 t80 -63.12 -36.86 27.19 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 119.746 -1.846 . . . . 0.0 110.337 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.643 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.2 Cg_exo -67.07 -56.39 0.24 Allowed 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.145 1.896 . . . . 0.0 111.855 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.76 -43.44 85.45 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -72.95 -49.9 26.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.301 -0.874 . . . . 0.0 110.641 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.514 ' HG ' ' HH ' ' A' ' 107' ' ' TYR . 7.4 t -76.8 -43.05 38.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.156 -0.965 . . . . 0.0 111.199 -178.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.5 tp10 -68.8 -50.35 50.93 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.577 -1.327 . . . . 0.0 110.996 -178.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.415 ' NZ ' ' CE1' ' A' ' 35' ' ' PHE . 42.4 mmtt -74.0 -35.76 64.44 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.115 -0.991 . . . . 0.0 111.699 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -111.02 -29.04 8.06 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.838 -1.163 . . . . 0.0 111.612 -177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 54.61 44.67 28.3 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.643 -1.286 . . . . 0.0 110.607 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.07 -30.88 71.48 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.117 -0.989 . . . . 0.0 110.398 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.431 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 23.1 t -154.24 -166.7 2.43 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.406 -178.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 74.2 p -127.53 159.81 63.82 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.595 -0.691 . . . . 0.0 109.753 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.45 -39.28 90.24 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.613 1.542 . . . . 0.0 112.256 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.59 -37.95 89.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.969 -1.082 . . . . 0.0 109.775 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.431 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 56.0 mt-10 -66.4 -44.73 82.2 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 26.6 tp -66.66 -51.72 53.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.349 0.595 . . . . 0.0 110.08 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -57.74 -47.02 83.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.0 109.863 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.13 91.91 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.238 -0.914 . . . . 0.0 109.877 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.96 -34.33 75.15 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.939 0.876 . . . . 0.0 108.7 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.414 ' CD1' ' SD ' ' A' ' 103' ' ' MET . 13.2 mt -63.59 -52.24 60.12 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -61.74 -36.85 82.17 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.458 -0.897 . . . . 0.0 109.04 179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.84 -31.64 81.08 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.666 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.92 -35.62 14.62 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.055 -1.262 . . . . 0.0 111.183 -178.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.666 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.7 mtm180 -62.6 143.52 57.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.714 -1.241 . . . . 0.0 110.203 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.552 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.4 mpt_? -70.9 166.54 20.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.633 -0.667 . . . . 0.0 109.935 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -104.35 110.06 22.16 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.365 -0.834 . . . . 0.0 109.29 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.459 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.832 0 O4'-C1'-C2' 108.399 2.09 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.577 0 O4'-C4'-C3' 107.783 2.183 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C4'-C3' 107.338 1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.077 0 O5'-C5'-C4' 113.271 2.194 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.716 0 O4'-C4'-C3' 107.556 1.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.727 0 O4'-C4'-C3' 107.72 2.12 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . 0.475 ' P ' ' HE ' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.607 1.387 0 O4'-C4'-C3' 107.289 1.689 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.512 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.172 0 O4'-C4'-C3' 107.825 2.225 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . 0.464 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.301 0 O5'-C5'-C4' 113.381 2.272 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O5'-C5'-C4' 113.478 2.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O5'-C5'-C4' 112.953 1.967 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.066 0 O5'-C5'-C4' 113.712 2.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.964 0 O4'-C4'-C3' 107.29 1.69 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.968 0 O4'-C4'-C3' 107.964 2.364 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.407 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.42 -2.373 0 C4'-C3'-C2' 104.686 1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.407 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.14 0 O4'-C4'-C3' 108.045 2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.801 0 O5'-C5'-C4' 112.63 1.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.43 ' OP2' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 O4'--C4' 1.429 -1.536 0 O5'-C5'-C4' 113.581 2.415 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.561 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.855 0 O4'-C4'-C3' 107.871 2.271 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.469 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.259 0 O5'-C5'-C4' 113.236 2.168 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.469 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O5'-C5'-C4' 113.578 2.413 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . 0.464 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.079 0 O5'-C5'-C4' 113.181 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.387 0 O4'-C1'-C2' 108.727 2.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O5'-C5'-C4' 113.375 2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.341 0 O4'-C4'-C3' 107.542 1.942 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.505 0 O5'-C5'-C4' 113.316 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.975 0 O5'-C5'-C4' 112.906 1.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O4'-C4'-C3' 107.8 2.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.061 0 C1'-O4'-C4' 106.577 -2.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.571 ' CG ' ' OD1' ' A' ' 44' ' ' ASN . 24.4 p90 -71.2 157.49 38.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.185 -1.185 . . . . 0.0 109.384 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.478 ' OG ' ' OE1' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -91.72 130.94 37.42 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.19 -0.944 . . . . 0.0 110.41 -178.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -55.95 -33.96 65.22 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.808 -0.557 . . . . 0.0 109.876 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.478 ' OE1' ' OG ' ' A' ' 5' ' ' SER . 57.8 mp0 -63.29 -42.01 99.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.042 -1.037 . . . . 0.0 108.801 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -58.58 -46.42 86.98 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.409 -0.807 . . . . 0.0 109.755 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.521 ' N ' ' CD ' ' A' ' 9' ' ' GLN . 1.8 mp0 -66.2 -39.33 89.56 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.039 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.17 -50.82 70.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.405 -0.809 . . . . 0.0 109.322 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.66 -41.66 99.18 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.055 -1.028 . . . . 0.0 109.213 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.58 -48.16 75.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.337 -0.852 . . . . 0.0 110.586 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.68 -37.15 73.34 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 120.674 -1.266 . . . . 0.0 107.796 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -54.52 -41.52 69.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -58.95 -29.91 67.49 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.304 -0.958 . . . . 0.0 108.762 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.9 mt -72.42 -38.45 68.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 111.333 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.524 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.0 m-85 -76.67 -33.53 58.27 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.509 -1.369 . . . . 0.0 110.457 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.3 mt-10 -65.72 -26.92 67.97 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.844 -1.16 . . . . 0.0 110.325 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.435 ' C ' ' O ' ' A' ' 18' ' ' GLU . 32.9 mt -38.39 -40.28 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 O-C-N 121.604 -0.685 . . . . 0.0 110.665 -179.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -170.74 164.45 8.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.744 -1.223 . . . . 0.0 110.758 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -89.84 68.38 7.41 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.396 0.617 . . . . 0.0 109.774 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -112.44 94.28 26.57 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.13 -41.72 40.61 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.01 1.807 . . . . 0.0 111.974 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -63.38 -41.72 98.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.107 -0.996 . . . . 0.0 108.611 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.582 HH22 ' CG ' ' A' ' 55' ' ' ASP . 66.3 ttt180 -58.68 -37.78 76.79 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.432 -0.793 . . . . 0.0 109.297 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.74 -49.35 78.06 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.359 -0.838 . . . . 0.0 108.845 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.62 -37.75 65.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.554 -0.716 . . . . 0.0 109.365 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.48 -61.22 2.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.269 -0.894 . . . . 0.0 110.695 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.45 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 54.7 mt -54.7 -47.56 73.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.284 -0.885 . . . . 0.0 109.295 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.524 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 88.1 m-20 -62.13 -46.17 90.19 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.821 -0.752 . . . . 0.0 109.395 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -67.1 -44.42 80.04 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.189 -0.944 . . . . 0.0 109.389 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.8 tp -55.56 -51.26 67.68 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.429 -0.795 . . . . 0.0 109.924 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.9 m-85 -61.0 -34.83 75.42 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 118.442 -1.303 . . . . 0.0 107.85 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -70.78 -52.84 18.08 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.559 -0.713 . . . . 0.0 110.524 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.68 -45.04 90.29 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.271 -0.893 . . . . 0.0 111.124 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.6 mtp -58.38 -33.57 69.75 Favored 'General case' 0 C--N 1.296 -1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.22 -179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -52.78 -39.12 61.99 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.96 -1.087 . . . . 0.0 108.652 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -71.03 -37.35 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -65.21 -30.45 71.35 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.76 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.73 0.74 64.11 Favored Glycine 0 N--CA 1.485 1.965 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.5 p -117.21 84.81 17.86 Favored Pre-proline 0 N--CA 1.491 1.58 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -83.77 141.14 9.53 Favored 'Trans proline' 0 C--N 1.301 -1.945 0 C-N-CA 122.507 2.138 . . . . 0.0 111.4 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.4 mt -76.36 97.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.997 -1.064 . . . . 0.0 109.725 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.571 ' OD1' ' CG ' ' A' ' 4' ' ' TRP . 24.5 t-20 -68.15 -45.94 72.18 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.409 ' NH1' H5'' ' B' ' 406' ' ' ' DA' . 16.5 mtm180 -130.03 132.16 46.12 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.7 mt -70.17 128.3 91.61 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 120.889 -1.132 . . . . 0.0 109.879 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -53.32 126.35 21.37 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 N-CA-C 108.777 -1.278 . . . . 0.0 108.777 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.588 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 51.2 mt -99.34 142.28 15.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.946 -1.096 . . . . 0.0 110.187 -178.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 79.6 mtp -137.99 124.43 20.7 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.77 40.42 3.21 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 57.27 22.84 8.11 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.332 0.587 . . . . 0.0 110.286 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.1 p -136.08 153.42 51.33 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.187 -0.946 . . . . 0.0 109.079 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -66.74 145.62 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.984 -1.072 . . . . 0.0 108.941 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 49.6 tp -80.14 124.44 28.78 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.271 -0.893 . . . . 0.0 110.023 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.582 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.0 m-20 -63.73 88.59 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -52.42 -24.86 8.55 Favored 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.883 -1.136 . . . . 0.0 109.235 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -80.3 -57.86 3.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.237 -0.914 . . . . 0.0 111.938 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -56.81 -38.24 72.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.525 -1.359 . . . . 0.0 109.34 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.0 tp -58.75 -52.4 65.86 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -51.91 -66.36 0.4 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.374 0.607 . . . . 0.0 109.832 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -42.83 -43.11 3.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.508 -0.745 . . . . 0.0 111.636 -178.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.49 -40.75 70.02 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.136 -1.426 . . . . 0.0 107.402 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.426 HG23 ' CE2' ' A' ' 102' ' ' TYR . 44.1 t -60.99 -45.5 98.41 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 C-N-CA 119.611 -0.836 . . . . 0.0 109.516 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.45 HG21 HD13 ' A' ' 64' ' ' ILE . 13.9 mm -68.75 -45.97 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.747 -1.22 . . . . 0.0 107.886 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -4.66 2.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.807 -0.558 . . . . 0.0 109.683 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.569 ' NH2' ' OE1' ' A' ' 80' ' ' GLU . 0.1 OUTLIER -101.89 9.39 40.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.103 -0.998 . . . . 0.0 108.841 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.51 7.85 87.72 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.348 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 122.8 142.63 6.21 Favored Glycine 0 N--CA 1.501 2.989 0 O-C-N 121.015 -1.285 . . . . 0.0 110.999 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.8 tp -52.18 -41.41 62.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.714 -0.874 . . . . 0.0 110.77 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.2 t -57.25 -41.76 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.747 -1.221 . . . . 0.0 108.916 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -59.07 -38.79 80.28 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.936 -1.102 . . . . 0.0 109.381 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.2 t -61.8 -46.86 95.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.329 -0.857 . . . . 0.0 110.208 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.9 mt -63.9 -61.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.072 -1.018 . . . . 0.0 109.979 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -58.89 -41.33 86.9 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.577 -0.702 . . . . 0.0 110.831 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -93.2 -7.36 45.45 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.978 -1.076 . . . . 0.0 110.985 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 72' ' ' VAL . 22.6 mtmt 57.4 56.99 4.66 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.125 -0.985 . . . . 0.0 110.492 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 18.2 mt -89.53 13.11 14.71 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.4 m95 -62.42 -42.86 99.76 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.635 -0.666 . . . . 0.0 109.362 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.3 mm-40 -49.69 -38.32 32.53 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.806 -1.184 . . . . 0.0 108.33 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.569 ' OE1' ' NH2' ' A' ' 66' ' ' ARG . 98.6 mt-10 -68.92 -40.48 79.03 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -72.47 -54.28 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.473 -0.767 . . . . 0.0 109.172 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.465 ' N ' ' O ' ' A' ' 78' ' ' TRP . 73.1 mt -53.15 -52.87 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 121.26 -0.9 . . . . 0.0 109.219 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -69.27 -40.28 77.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 109.344 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.73 -33.73 42.81 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.8 mt -87.66 -8.32 56.31 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.376 -1.073 . . . . 0.0 108.851 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 65.26 39.89 5.15 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.4 mt -73.03 139.71 79.91 Favored Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.338 -0.851 . . . . 0.0 108.752 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.51 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.6 Cg_endo -67.26 142.57 61.06 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.946 1.764 . . . . 0.0 111.892 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -61.37 1.16 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.268 -0.895 . . . . 0.0 109.826 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.51 ' H ' ' C ' ' A' ' 88' ' ' PRO . 60.4 p -65.65 -24.31 67.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.263 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.435 HD11 HG23 ' A' ' 91' ' ' ILE . 90.9 mt -98.13 106.31 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.957 -1.089 . . . . 0.0 109.001 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -78.5 -22.57 47.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.107 -0.995 . . . . 0.0 108.657 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 27.8 m -95.49 34.29 1.48 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.402 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -62.01 -65.9 0.62 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.067 -1.021 . . . . 0.0 108.854 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.85 27.97 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.304 -0.873 . . . . 0.0 109.52 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.488 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.4 tp -58.53 -44.29 89.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.861 -1.149 . . . . 0.0 109.044 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 m -61.79 -40.96 97.03 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 120.942 -1.099 . . . . 0.0 109.441 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.4 mt -68.38 -45.83 71.66 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.399 -0.813 . . . . 0.0 110.298 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.623 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 34.9 ttp180 -64.45 -49.85 69.85 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.136 -0.978 . . . . 0.0 110.622 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -56.16 -54.82 40.59 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.112 -0.992 . . . . 0.0 109.804 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -62.58 -42.59 99.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.063 -1.023 . . . . 0.0 111.024 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.426 ' CE2' HG23 ' A' ' 63' ' ' VAL . 5.2 t80 -56.97 -43.17 81.36 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 120.441 -1.412 . . . . 0.0 109.44 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 42.5 mtt -54.32 -53.9 47.59 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.491 -0.755 . . . . 0.0 111.185 -179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.1 mttm -72.25 -57.14 4.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.895 -1.128 . . . . 0.0 112.47 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -83.02 -15.09 52.49 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -175.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 mt -137.17 17.87 2.98 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 120.082 -1.636 . . . . 0.0 112.893 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.631 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 37.6 t80 -72.08 -35.01 3.17 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 120.153 -1.592 . . . . 0.0 110.617 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.9 Cg_endo -83.79 -39.06 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.757 1.638 . . . . 0.0 112.799 -179.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.61 -41.55 86.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.625 -1.297 . . . . 0.0 107.857 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -71.86 -50.79 26.39 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.538 -0.726 . . . . 0.0 110.067 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.578 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -74.92 -44.0 51.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.496 -0.753 . . . . 0.0 111.083 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 38.8 tp10 -66.08 -47.36 74.53 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.901 -1.124 . . . . 0.0 110.605 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -74.87 -33.94 62.16 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.162 -0.961 . . . . 0.0 111.163 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -120.52 -27.98 5.04 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.186 -0.946 . . . . 0.0 111.848 -177.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.578 ' N ' ' O ' ' A' ' 111' ' ' CYS . 35.5 t-20 57.25 44.91 21.25 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.564 -1.335 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 68.5 mt -67.52 -30.39 70.03 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.201 -0.937 . . . . 0.0 111.249 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.685 ' HG ' ' H ' ' A' ' 118' ' ' THR . 8.8 t -153.13 -169.1 3.22 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 118.553 -1.259 . . . . 0.0 111.743 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.685 ' H ' ' HG ' ' A' ' 117' ' ' SER . 70.1 p -126.47 163.23 41.85 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.754 -0.592 . . . . 0.0 109.643 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.6 -37.95 85.08 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 121.571 1.514 . . . . 0.0 111.971 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.54 -36.72 83.51 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.995 . . . . 0.0 109.037 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.479 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.5 mt-10 -66.87 -48.78 67.71 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 56.5 tp -57.54 -58.01 10.18 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.525 -0.735 . . . . 0.0 109.974 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -56.8 -45.71 82.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.496 -0.753 . . . . 0.0 109.394 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.13 -36.5 77.65 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.802 -1.186 . . . . 0.0 108.466 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.18 -35.91 74.29 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 19.3 mt -60.14 -52.5 60.58 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -64.31 -38.03 89.58 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.01 -30.25 69.71 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.85 -32.88 13.05 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.846 -1.385 . . . . 0.0 110.94 -178.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.699 HH22 ' P ' ' C' ' 421' ' ' ' DT' . 0.0 OUTLIER -61.45 143.61 55.57 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.773 -1.204 . . . . 0.0 109.362 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.555 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 0.3 OUTLIER -75.15 151.83 38.51 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.557 -0.714 . . . . 0.0 110.335 -179.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -91.29 105.25 17.65 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.295 -0.878 . . . . 0.0 108.736 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.74 0 O4'-C1'-C2' 108.203 1.912 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.283 0 O4'-C4'-C3' 107.701 2.101 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.86 0 O4'-C4'-C3' 107.484 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.273 0 O4'-C4'-C3' 107.837 2.237 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.703 0 O4'-C4'-C3' 107.612 2.012 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . 0.409 H5'' ' NH1' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.723 0 O4'-C4'-C3' 107.567 1.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.784 0 O4'-C4'-C3' 107.688 2.088 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.588 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.522 1.345 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.107 0 O5'-C5'-C4' 113.027 2.019 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C1'-C2' 108.634 2.304 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.047 0 O5'-C5'-C4' 113.266 2.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.746 0 O5'-C5'-C4' 113.23 2.164 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.745 0 O4'-C4'-C3' 107.803 2.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 0 O4'-C4'-C3' 107.338 1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.435 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.422 -2.156 0 C4'-C3'-C2' 104.675 1.475 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.435 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 2.048 0 O4'-C1'-C2' 108.877 2.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O5'-C5'-C4' 112.76 1.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.545 ' O2 ' ' NH2' ' A' ' 131' ' ' ARG . . . . . . . . 0 P--O5' 1.609 1.574 0 O5'-C5'-C4' 113.623 2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.56 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 107.641 2.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.699 ' P ' HH22 ' A' ' 130' ' ' ARG . . . . . . . . 0 P--O5' 1.616 2.28 0 O5'-C5'-C4' 113.085 2.06 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.289 0 O5'-C5'-C4' 113.483 2.345 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.82 2.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-C2' 108.827 2.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.116 0 O4'-C4'-C3' 108.157 2.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C4'-C3' 107.637 2.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.452 0 O4'-C4'-C3' 107.657 2.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.85 0 O5'-C5'-C4' 112.804 1.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O4'-C4'-C3' 107.781 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.046 0 C1'-O4'-C4' 106.402 -2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.632 ' CE2' ' ND2' ' A' ' 44' ' ' ASN . 47.1 p90 -63.99 151.71 42.09 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.221 -1.164 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.707 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -94.9 136.03 35.71 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.374 -0.829 . . . . 0.0 109.683 -179.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -56.17 -38.58 71.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.599 -0.688 . . . . 0.0 110.122 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -64.44 -41.75 96.38 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.031 -1.043 . . . . 0.0 109.261 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.707 ' H ' ' HG ' ' A' ' 5' ' ' SER . 99.0 mt-10 -55.15 -42.96 73.76 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.256 -0.902 . . . . 0.0 109.676 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.54 ' NE2' ' C ' ' A' ' 44' ' ' ASN . 42.2 mm-40 -67.26 -39.1 86.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.955 . . . . 0.0 109.253 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.65 ' CZ ' ' NE ' ' A' ' 14' ' ' ARG . 52.4 t80 -54.91 -50.18 69.44 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.29 -0.881 . . . . 0.0 108.95 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -62.86 -40.78 98.55 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.025 -1.047 . . . . 0.0 109.59 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.65 -47.98 73.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.832 . . . . 0.0 111.006 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.11 -38.06 73.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 120.702 -1.249 . . . . 0.0 108.992 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.65 ' NE ' ' CZ ' ' A' ' 10' ' ' PHE . 7.7 mmt-85 -55.91 -39.82 72.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.392 -1.443 . . . . 0.0 108.347 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -58.71 -29.0 66.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mt -75.32 -39.51 59.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.404 -0.81 . . . . 0.0 111.634 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.4 m-85 -74.86 -34.16 62.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.5 -1.375 . . . . 0.0 110.578 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 19' ' ' ILE . 77.8 mm-40 -64.77 -26.99 68.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.923 -1.111 . . . . 0.0 110.154 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.49 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 41.8 mt -39.87 -40.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.72 -0.612 . . . . 0.0 110.652 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.49 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.4 m120 -171.13 160.95 6.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.716 -1.24 . . . . 0.0 110.448 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 52.3 p30 -91.65 64.42 4.9 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.49 0.662 . . . . 0.0 109.724 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.0 107.66 60.83 Favored Pre-proline 0 N--CA 1.489 1.502 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -46.87 -51.78 8.68 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.031 1.821 . . . . 0.0 112.513 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.16 -36.1 78.89 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.169 -0.957 . . . . 0.0 109.337 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.636 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -59.41 -44.97 92.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -62.32 -53.27 57.51 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.308 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -51.69 -37.67 51.75 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.525 -0.735 . . . . 0.0 109.208 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -62.01 -62.58 1.69 Allowed 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.468 -0.77 . . . . 0.0 110.318 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 57.5 mt -54.77 -45.45 74.24 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.487 -0.758 . . . . 0.0 109.148 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -61.73 -47.64 84.3 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.035 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -66.68 -44.82 80.75 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.415 -0.803 . . . . 0.0 109.762 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.43 -51.74 67.25 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.349 -0.844 . . . . 0.0 110.898 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -62.53 -33.06 74.15 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 118.104 -1.438 . . . . 0.0 108.207 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 m -68.99 -55.03 12.13 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.408 -0.807 . . . . 0.0 110.203 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.405 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 46.3 t80 -61.91 -38.45 88.43 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.894 . . . . 0.0 111.656 -178.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.5 mmm -58.22 -34.79 70.8 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.857 -1.152 . . . . 0.0 110.748 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -56.27 -37.63 70.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.772 -1.205 . . . . 0.0 109.25 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.1 -28.47 57.53 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.405 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 13.6 mmm180 -66.7 -32.05 73.1 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.733 -0.787 . . . . 0.0 109.428 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.55 -2.21 62.49 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.725 -2.15 . . . . 0.0 107.725 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.8 p -118.72 84.9 26.18 Favored Pre-proline 0 N--CA 1.49 1.545 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.17 12.34 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.527 2.151 . . . . 0.0 111.207 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.82 99.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.048 -1.032 . . . . 0.0 110.042 -178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 4' ' ' TRP . 27.5 m120 -79.11 -3.96 47.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.25 -0.906 . . . . 0.0 108.648 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -176.45 123.2 0.16 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.279 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.29 144.06 91.66 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 120.953 -1.092 . . . . 0.0 108.93 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -67.08 138.85 48.89 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 121.501 1.467 . . . . 0.0 109.558 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.588 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 35.3 mt -105.55 142.69 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.02 -1.05 . . . . 0.0 110.269 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 80.3 mtp -134.52 125.71 27.89 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.49 40.03 8.59 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.5 mttt 58.94 25.02 13.22 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.857 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 84.8 p -137.56 154.58 49.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.369 -0.832 . . . . 0.0 109.524 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.26 144.3 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.197 -0.939 . . . . 0.0 109.975 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.0 tp -77.16 122.63 25.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.544 -0.722 . . . . 0.0 109.396 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -61.86 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.656 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.28 -26.87 42.86 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 120.92 -1.112 . . . . 0.0 109.149 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -78.1 -63.46 1.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.136 -0.978 . . . . 0.0 111.564 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -57.1 -38.73 73.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.684 -1.26 . . . . 0.0 110.267 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 tp -58.72 -43.47 90.14 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.546 -1.346 . . . . 0.0 107.853 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.415 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.2 t80 -60.03 -67.5 0.38 Allowed 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.412 0.625 . . . . 0.0 109.547 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -41.94 -41.4 2.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.515 -0.74 . . . . 0.0 111.429 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.1 -44.07 69.74 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.12 -1.432 . . . . 0.0 107.743 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.402 HG22 ' CE2' ' A' ' 102' ' ' TYR . 23.5 t -58.14 -45.22 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.393 -0.817 . . . . 0.0 110.403 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.415 HG13 ' CE2' ' A' ' 60' ' ' TYR . 5.1 mm -71.01 -33.43 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 120.735 -1.228 . . . . 0.0 108.313 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.41 ' HB1' HH11 ' A' ' 66' ' ' ARG . . . -54.47 -24.38 20.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.646 -178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.471 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -92.46 -2.55 56.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.809 -1.182 . . . . 0.0 108.799 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.1 16.74 66.55 Favored Glycine 0 N--CA 1.491 2.312 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.434 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 145.28 128.11 2.0 Allowed Glycine 0 N--CA 1.498 2.801 0 CA-C-N 119.675 1.737 . . . . 0.0 111.85 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tp -46.92 -38.33 10.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.63 -0.924 . . . . 0.0 109.695 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 88.0 t -60.61 -41.19 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.455 -179.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -58.61 -42.99 89.46 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.878 -1.139 . . . . 0.0 109.695 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 76' ' ' LYS . 61.9 t -59.68 -43.43 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 109.349 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -66.84 -56.89 12.13 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 120.851 -1.156 . . . . 0.0 109.623 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -57.79 -41.77 82.8 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.161 -0.962 . . . . 0.0 110.312 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -92.27 -9.58 41.55 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.178 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.616 ' N ' ' O ' ' A' ' 72' ' ' VAL . 28.3 mtmt 58.03 57.7 3.94 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -0.868 . . . . 0.0 109.67 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.6 mt -92.98 16.6 12.33 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.949 -1.094 . . . . 0.0 108.52 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.45 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.1 m95 -64.26 -39.75 94.59 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.439 ' C ' ' O ' ' A' ' 78' ' ' TRP . 16.3 mm100 -48.81 -38.88 23.38 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.287 -1.365 . . . . 0.0 108.026 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.471 ' CB ' HH21 ' A' ' 66' ' ' ARG . 78.8 mm-40 -69.64 -40.92 76.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.83 -54.47 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.45 ' N ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt -50.33 -54.2 9.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -68.4 -38.49 81.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.77 -34.0 50.16 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.1 mt -88.13 -8.33 55.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.35 -1.088 . . . . 0.0 108.823 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 66.25 39.5 4.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.781 -0.575 . . . . 0.0 109.934 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.0 mt -73.79 146.74 85.86 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.584 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.7 Cg_endo -74.04 139.96 27.69 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 C-N-CA 122.081 1.854 . . . . 0.0 112.149 179.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.1 p -56.38 -0.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.822 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.584 ' H ' ' C ' ' A' ' 88' ' ' PRO . 86.8 p -67.31 -24.2 65.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.157 -0.964 . . . . 0.0 110.12 -178.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 94' ' ' ALA . 81.5 mt -96.99 102.01 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 120.751 -1.218 . . . . 0.0 109.274 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 52.3 p -73.43 -28.04 61.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 108.899 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.447 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 69.4 m -92.04 30.51 1.41 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -61.83 -65.55 0.67 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.287 -0.883 . . . . 0.0 108.684 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.37 -51.27 35.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 109.178 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.04 -42.71 90.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.976 -1.077 . . . . 0.0 108.756 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 93' ' ' SER . 52.2 m -60.99 -40.84 95.03 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.246 -0.909 . . . . 0.0 108.707 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.29 -48.18 62.4 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.608 -0.682 . . . . 0.0 109.929 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -65.89 -49.03 69.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.144 -0.973 . . . . 0.0 110.919 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -55.83 -54.73 40.95 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 109.846 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.7 -40.9 98.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.274 -0.891 . . . . 0.0 111.115 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.402 ' CE2' HG22 ' A' ' 63' ' ' VAL . 3.6 t80 -57.78 -41.05 81.24 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.454 -1.404 . . . . 0.0 109.571 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.493 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.1 ttm -53.65 -54.1 42.6 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.426 -0.796 . . . . 0.0 111.552 -178.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -72.0 -54.5 9.72 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.661 -1.275 . . . . 0.0 113.164 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -85.41 -44.59 12.63 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 mt -97.96 -7.69 29.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.315 -1.49 . . . . 0.0 114.231 -175.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.8 t80 -59.87 -38.18 57.48 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 119.84 -1.788 . . . . 0.0 109.209 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 15.8 Cg_exo -67.71 -52.07 0.6 Allowed 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.333 2.022 . . . . 0.0 112.036 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -60.67 -38.45 84.98 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -73.33 -52.2 14.72 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.619 -0.676 . . . . 0.0 109.95 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 73.0 m -71.24 -43.87 66.42 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.475 -0.766 . . . . 0.0 110.888 -178.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -67.77 -47.12 70.07 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.018 -1.051 . . . . 0.0 111.407 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt -74.78 -33.59 62.29 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.99 -1.069 . . . . 0.0 112.145 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.47 -25.13 3.78 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.853 -1.154 . . . . 0.0 111.641 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 60.64 48.76 7.0 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.687 -1.258 . . . . 0.0 110.285 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 18.5 mt -67.1 -33.85 76.35 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.106 -0.996 . . . . 0.0 111.264 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.556 ' OG ' ' N ' ' A' ' 118' ' ' THR . 26.6 t -155.43 -166.62 2.3 Favored 'General case' 0 N--CA 1.496 1.828 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.315 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.556 ' N ' ' OG ' ' A' ' 117' ' ' SER . 69.7 p -130.6 156.76 79.26 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.562 -0.711 . . . . 0.0 110.078 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -51.72 -42.82 54.92 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 121.906 1.737 . . . . 0.0 112.493 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.98 -38.96 93.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.743 -1.223 . . . . 0.0 109.512 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.423 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.9 mt-10 -65.64 -43.57 89.06 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 24.8 tp -68.49 -50.49 51.94 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.65 -0.656 . . . . 0.0 110.087 179.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -57.72 -46.38 84.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.052 -1.03 . . . . 0.0 109.167 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.21 96.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.405 -0.81 . . . . 0.0 109.941 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.0 -34.92 77.43 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.535 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -65.12 -48.13 84.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.72 -37.57 84.68 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.952 -1.092 . . . . 0.0 108.256 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.41 -33.0 86.07 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.6 p-10 -93.11 -31.77 14.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.797 -1.413 . . . . 0.0 110.267 -179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.6 mtp180 -64.82 143.35 58.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.761 -1.212 . . . . 0.0 109.521 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.507 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.0 mpt_? -65.16 151.16 46.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 0.0 109.922 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -84.54 96.26 9.09 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.346 -0.847 . . . . 0.0 108.952 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.899 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.404 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.425 -1.918 0 O4'-C1'-C2' 108.187 1.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.512 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-C2' 108.638 2.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.735 0 O4'-C4'-C3' 107.573 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.084 0 O5'-C5'-C4' 113.25 2.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.798 0 O5'-C5'-C4' 113.048 2.034 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.902 0 O5'-C5'-C4' 113.132 2.095 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O4'-C4'-C3' 107.41 1.81 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.588 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.15 0 O4'-C4'-C3' 107.848 2.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.007 0 O5'-C5'-C4' 113.143 2.102 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C4'-C3' 107.866 2.266 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.834 0 O5'-C5'-C4' 113.191 2.136 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.94 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.042 0 O4'-C4'-C3' 107.777 2.177 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.898 0 O4'-C4'-C3' 107.683 2.083 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.167 0 O4'-C4'-C3' 107.97 2.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.839 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O4'-C1'-C2' 108.976 2.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.185 0 C4'-C3'-C2' 105.725 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O5'-C5'-C4' 112.839 1.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.522 0 O5'-C5'-C4' 113.803 2.574 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.448 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.427 -1.715 0 O4'-C4'-C3' 107.744 2.144 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.447 ' O4 ' ' OG ' ' A' ' 93' ' ' SER . . . . . . . . 0 C5'--C4' 1.529 2.246 0 O4'-C4'-C3' 107.943 2.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.721 0 O5'-C5'-C4' 113.374 2.267 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.539 0 O5'-C5'-C4' 113.465 2.332 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C1'-C2' 108.671 2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.107 0 O4'-C4'-C3' 107.977 2.377 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.153 0 O4'-C4'-C3' 107.484 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.378 0 O4'-C4'-C3' 107.79 2.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C4'-C3' 107.66 2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.027 0 O4'-C4'-C3' 107.815 2.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 O4'-C4'-C3' 107.599 1.999 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 44.2 p90 -70.21 150.19 46.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.212 -1.17 . . . . 0.0 109.956 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.71 137.67 32.17 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.385 -0.822 . . . . 0.0 109.833 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -55.81 -36.65 67.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.56 -0.712 . . . . 0.0 110.108 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -62.91 -42.98 99.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.866 -1.147 . . . . 0.0 109.01 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -55.56 -41.43 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.239 -0.913 . . . . 0.0 109.054 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.59 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 24.9 mm-40 -71.7 -37.23 70.71 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.359 -0.838 . . . . 0.0 109.037 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.34 -51.31 70.36 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.175 -0.953 . . . . 0.0 109.388 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -63.29 -44.37 95.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.164 -0.96 . . . . 0.0 109.432 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -66.05 -48.54 70.71 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.881 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.5 -36.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.727 -1.233 . . . . 0.0 108.603 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -56.7 -39.4 73.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.495 -1.378 . . . . 0.0 107.863 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -58.34 -32.08 68.18 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 mt -71.35 -40.29 70.78 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.0 111.934 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -75.5 -32.92 60.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.452 -1.405 . . . . 0.0 110.119 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.466 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.4 mt-10 -67.08 -26.15 66.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.995 -1.066 . . . . 0.0 110.48 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.466 ' C ' ' O ' ' A' ' 18' ' ' GLU . 34.4 mt -38.36 -41.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 121.566 -0.708 . . . . 0.0 110.502 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.443 ' C ' ' OD1' ' A' ' 20' ' ' ASN . 36.5 p30 -172.71 165.65 5.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.873 -1.142 . . . . 0.0 110.309 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -91.1 69.52 6.2 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.663 -0.648 . . . . 0.0 109.63 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -112.19 103.87 55.62 Favored Pre-proline 0 N--CA 1.493 1.695 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -48.62 -42.92 35.19 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.066 1.844 . . . . 0.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -62.54 -38.03 88.44 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.276 -0.89 . . . . 0.0 108.805 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.608 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -60.54 -44.96 95.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.481 -0.762 . . . . 0.0 109.874 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.31 -53.87 48.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.226 -0.921 . . . . 0.0 109.729 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -51.77 -39.76 59.13 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.32 -60.5 3.31 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.425 -0.797 . . . . 0.0 109.933 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 72.7 mt -54.75 -46.91 74.38 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 109.291 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.519 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 93.6 m-20 -63.03 -47.34 83.47 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.458 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -67.09 -43.33 82.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.181 -0.949 . . . . 0.0 109.325 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.403 HD12 ' CD2' ' A' ' 109' ' ' TYR . 55.3 tp -60.25 -51.51 69.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.342 -0.849 . . . . 0.0 110.345 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.02 -35.29 74.75 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 117.75 -1.58 . . . . 0.0 107.715 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -69.74 -51.48 33.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.596 -0.69 . . . . 0.0 110.599 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -59.55 -43.92 93.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.245 -0.91 . . . . 0.0 111.92 -178.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.0 mtp -57.38 -31.33 65.69 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 111.268 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -54.13 -40.37 67.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.493 -1.38 . . . . 0.0 108.553 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -65.99 -40.19 90.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.449 -0.782 . . . . 0.0 109.186 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -63.76 -30.69 71.76 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.632 -0.667 . . . . 0.0 110.194 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.57 1.55 68.43 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 107.914 -2.075 . . . . 0.0 107.914 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.1 p -118.8 84.45 25.42 Favored Pre-proline 0 N--CA 1.487 1.411 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.9 146.08 10.23 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.622 2.214 . . . . 0.0 111.397 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 11.7 mt -79.44 95.22 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 119.126 -1.03 . . . . 0.0 109.454 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.59 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 77.5 m-20 -64.4 -43.55 94.09 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -136.42 133.38 36.61 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.98 132.49 88.49 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 120.777 -1.202 . . . . 0.0 108.714 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -58.99 140.11 93.87 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 N-CA-C 108.82 -1.262 . . . . 0.0 108.82 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.565 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 10.9 mt -106.22 146.02 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.954 -1.091 . . . . 0.0 110.839 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.405 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 82.6 mtp -143.54 121.11 11.76 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 69.18 39.45 1.71 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -178.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt 56.78 22.2 6.73 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.547 0.689 . . . . 0.0 109.576 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.1 m -132.19 150.52 52.14 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -67.65 146.72 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.832 -1.168 . . . . 0.0 108.966 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.0 tp -74.6 118.06 17.14 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 109.778 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -62.27 93.26 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.327 -0.858 . . . . 0.0 108.95 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -54.09 -26.99 29.98 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.054 -1.029 . . . . 0.0 109.405 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -78.88 -59.34 2.82 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.118 -0.988 . . . . 0.0 111.666 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -57.41 -37.6 73.01 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.502 -1.374 . . . . 0.0 109.519 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.21 -46.66 87.87 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.433 ' O ' ' C ' ' A' ' 61' ' ' ASN . 46.2 t80 -61.28 -70.64 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.387 0.613 . . . . 0.0 109.551 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 60' ' ' TYR . 54.3 t30 -38.26 -40.83 0.56 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.657 -0.652 . . . . 0.0 111.01 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.569 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 52.0 mt -72.44 -46.67 53.98 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.356 -1.338 . . . . 0.0 108.277 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.428 HG21 ' CE2' ' A' ' 102' ' ' TYR . 18.9 t -56.37 -43.53 77.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.214 -0.929 . . . . 0.0 110.491 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.412 HG13 ' CE2' ' A' ' 60' ' ' TYR . 5.8 mm -70.42 -35.22 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.712 -1.243 . . . . 0.0 108.11 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.68 -19.68 17.7 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.765 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.618 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.3 mmt-85 -94.1 -0.38 55.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.735 -1.228 . . . . 0.0 108.234 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 14.13 80.16 Favored Glycine 0 N--CA 1.492 2.414 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.609 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 147.3 126.21 1.66 Allowed Glycine 0 N--CA 1.5 2.935 0 O-C-N 120.065 -1.844 . . . . 0.0 111.582 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.6 tp -47.33 -41.01 18.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.492 -1.005 . . . . 0.0 109.956 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.42 -42.19 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.031 -1.043 . . . . 0.0 110.197 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -54.98 -37.53 66.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 108.749 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.1 t -65.91 -43.07 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.521 -0.737 . . . . 0.0 110.502 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.9 mt -66.89 -58.65 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.701 -1.249 . . . . 0.0 110.239 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -58.64 -40.75 84.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.157 -0.964 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.4 mmtp -92.64 -10.2 38.21 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.157 -0.964 . . . . 0.0 110.614 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 72' ' ' VAL . 49.5 mttp 58.69 56.96 3.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.519 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.46 15.72 10.2 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.837 -1.164 . . . . 0.0 108.12 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.492 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.9 m95 -65.14 -40.82 94.95 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' NE2' ' OP2' ' C' ' 419' ' ' ' DC' . 97.0 mm-40 -49.06 -38.43 24.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.192 -1.403 . . . . 0.0 107.995 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.618 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.0 mt-10 -69.14 -40.86 77.98 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.9 mt -71.67 -52.48 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.492 ' N ' ' O ' ' A' ' 78' ' ' TRP . 83.8 mt -51.85 -53.75 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.633 -0.667 . . . . 0.0 110.115 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 79' ' ' GLN . 59.9 mttp -70.88 -37.56 73.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.77 -1.206 . . . . 0.0 110.019 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -54.96 -33.7 57.18 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.264 -1.535 . . . . 0.0 109.264 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.2 mt -86.7 -10.54 53.48 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.4 -1.059 . . . . 0.0 108.566 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 67.78 40.66 2.37 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.34 0.59 . . . . 0.0 110.513 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.72 141.55 79.31 Favored Pre-proline 0 N--CA 1.487 1.405 0 O-C-N 121.157 -0.964 . . . . 0.0 108.634 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.587 ' C ' ' H ' ' A' ' 90' ' ' SER . 39.8 Cg_endo -71.59 142.03 39.31 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 121.979 1.786 . . . . 0.0 112.076 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.0 p -55.73 0.01 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.587 ' H ' ' C ' ' A' ' 88' ' ' PRO . 20.4 m -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.077 -1.015 . . . . 0.0 109.937 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 91' ' ' ILE . 81.3 mt -92.86 101.57 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 120.781 -1.199 . . . . 0.0 109.258 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -71.26 -29.53 65.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.226 -0.921 . . . . 0.0 109.179 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.43 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 50.3 m -96.32 40.07 1.14 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.46 -0.775 . . . . 0.0 109.472 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -62.6 1.51 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.945 . . . . 0.0 108.721 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.6 -51.06 22.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.289 -0.882 . . . . 0.0 109.694 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.1 tp -58.53 -41.22 85.0 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.603 -1.31 . . . . 0.0 108.61 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.584 ' O ' ' NE2' ' A' ' 101' ' ' GLN . 35.8 m -63.87 -41.31 97.78 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.272 -0.893 . . . . 0.0 109.271 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mt -68.49 -46.35 69.92 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.266 -0.896 . . . . 0.0 110.692 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.731 ' NH1' HD22 ' A' ' 129' ' ' ASN . 34.6 ttp180 -68.17 -48.57 64.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.137 -0.977 . . . . 0.0 110.833 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.9 m -55.54 -53.54 55.13 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.058 -1.026 . . . . 0.0 110.017 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.584 ' NE2' ' O ' ' A' ' 97' ' ' THR . 8.4 mt-30 -64.68 -41.19 96.23 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.954 -1.091 . . . . 0.0 111.548 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.428 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.3 t80 -57.23 -41.98 80.56 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 120.317 -1.489 . . . . 0.0 109.007 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.446 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 83.1 mtp -54.24 -57.69 10.23 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-O 121.471 0.653 . . . . 0.0 112.246 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -71.17 -51.47 24.67 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.414 -1.429 . . . . 0.0 112.099 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.426 ' CD1' ' N ' ' A' ' 105' ' ' TYR . 60.6 m-85 -84.67 -46.14 11.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -175.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.47 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.9 mp -103.13 11.97 36.41 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.355 -1.466 . . . . 0.0 113.835 -176.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.541 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.5 t80 -68.79 -38.4 11.65 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 119.903 -1.748 . . . . 0.0 111.492 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 86.9 Cg_endo -79.1 -41.57 0.22 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.535 1.49 . . . . 0.0 112.514 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.403 ' CD2' HD12 ' A' ' 32' ' ' LEU . 10.9 t80 -58.47 -41.92 86.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.856 -1.152 . . . . 0.0 107.975 178.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -70.65 -49.58 45.9 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.443 0.64 . . . . 0.0 110.213 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.516 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.5 t -74.82 -44.43 49.33 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.379 -0.826 . . . . 0.0 110.675 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.0 tp10 -66.4 -46.05 77.93 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.347 -0.846 . . . . 0.0 111.061 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -75.08 -33.2 61.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.039 -1.038 . . . . 0.0 111.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.02 -25.18 3.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.844 -1.16 . . . . 0.0 112.133 -177.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.0 t-20 59.26 50.7 7.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.579 -1.326 . . . . 0.0 110.506 178.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 26.2 mt -68.37 -32.17 72.06 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.346 -0.847 . . . . 0.0 111.839 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 10.0 t -154.66 -167.02 2.48 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 118.465 -1.294 . . . . 0.0 111.502 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.7 p -123.77 160.3 52.02 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 121.771 -0.58 . . . . 0.0 109.574 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -59.98 -38.69 76.75 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.348 1.365 . . . . 0.0 112.007 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.56 86.71 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.987 -1.071 . . . . 0.0 109.561 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.25 -48.37 67.95 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 39.8 tp -63.22 -53.2 56.85 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.486 -0.759 . . . . 0.0 109.92 179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -57.76 -44.33 86.09 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.002 -1.061 . . . . 0.0 109.235 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.18 91.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.738 . . . . 0.0 111.074 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -69.2 -32.08 71.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.027 -1.046 . . . . 0.0 109.17 -179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.684 ' CG2' ' NH2' ' A' ' 130' ' ' ARG . 12.0 mt -63.58 -49.42 82.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.001 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.17 -35.93 78.82 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.45 -17.9 67.04 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.731 HD22 ' NH1' ' A' ' 99' ' ' ARG . 17.2 p-10 -94.3 -30.58 14.46 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.842 -1.387 . . . . 0.0 110.644 -179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.684 ' NH2' ' CG2' ' A' ' 126' ' ' ILE . 1.1 mtt-85 -61.73 145.82 51.23 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.65 -1.281 . . . . 0.0 110.112 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.543 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.7 mpt_? -69.41 149.13 48.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.526 -0.734 . . . . 0.0 109.299 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.39 1.39 16.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.161 -0.962 . . . . 0.0 110.132 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.812 0 O4'-C1'-C2' 107.865 1.605 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.622 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 1.983 0 O4'-C1'-C2' 108.737 2.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.951 0 O4'-C4'-C3' 107.554 1.954 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O5'-C5'-C4' 113.318 2.227 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O5'-C5'-C4' 113.297 2.212 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.77 0 O5'-C5'-C4' 113.043 2.03 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.755 0 O4'-C4'-C3' 107.367 1.767 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.565 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.181 0 O4'-C4'-C3' 107.849 2.249 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . 0.5 ' C5 ' ' N6 ' ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.003 0 O5'-C5'-C4' 113.01 2.007 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . 0.5 ' N6 ' ' C5 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.327 0 O4'-C4'-C3' 107.985 2.385 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.872 0 O5'-C5'-C4' 113.055 2.039 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O5'-C5'-C4' 113.475 2.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.798 0 O4'-C4'-C3' 107.978 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.857 0 O4'-C4'-C3' 107.398 1.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.224 0 O4'-C4'-C3' 107.893 2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.444 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.261 0 O4'-C1'-C2' 107.71 1.463 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.444 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C4'-C3' 107.954 2.354 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.465 ' C2 ' ' C2 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.668 0 O4'-C4'-C3' 107.2 1.6 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.465 ' C2 ' ' C2 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.606 1.302 0 O5'-C5'-C4' 113.7 2.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.58 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.427 -1.716 0 O4'-C4'-C3' 107.786 2.186 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.43 ' O4 ' ' OG ' ' A' ' 93' ' ' SER . . . . . . . . 0 P--O5' 1.61 1.718 0 O4'-C4'-C3' 107.789 2.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.576 0 O5'-C5'-C4' 113.045 2.032 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.005 0 O5'-C5'-C4' 113.365 2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.988 0 C4'-C3'-C2' 105.628 2.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.841 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C4'-C3' 107.629 2.029 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.159 0 O4'-C4'-C3' 107.922 2.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.73 0 O4'-C4'-C3' 107.733 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C4'-C3' 107.912 2.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C4'-C3' 107.601 2.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.335 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -114.23 75.88 0.95 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 109.525 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.4 p -114.2 145.53 41.57 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.263 -0.898 . . . . 0.0 109.65 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -54.85 -38.27 67.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.456 -0.777 . . . . 0.0 110.219 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.5 -45.69 91.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.794 -1.191 . . . . 0.0 109.643 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.26 -40.87 91.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 109.619 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.596 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 20.5 mm-40 -68.91 -42.73 76.44 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.432 -0.792 . . . . 0.0 110.046 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.02 -46.67 84.91 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.291 -0.881 . . . . 0.0 109.826 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -62.27 -43.69 98.25 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.009 -1.057 . . . . 0.0 109.54 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -65.91 -50.21 65.25 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.457 -0.777 . . . . 0.0 111.09 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.415 ' CG1' ' O ' ' A' ' 9' ' ' GLN . 2.2 p -68.15 -39.02 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.705 -1.247 . . . . 0.0 109.455 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.52 -38.35 87.06 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.274 -1.516 . . . . 0.0 107.757 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -32.41 64.42 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.085 -1.046 . . . . 0.0 108.179 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.5 mt -66.85 -41.2 87.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.316 -0.865 . . . . 0.0 111.734 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.426 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 97.5 m-85 -75.7 -36.59 59.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.363 -1.461 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -70.3 -3.86 19.27 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.072 -1.018 . . . . 0.0 110.97 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.451 ' CG2' ' NH1' ' A' ' 25' ' ' ARG . 8.9 mt -56.66 -41.42 74.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 O-C-N 121.236 -0.915 . . . . 0.0 109.467 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -171.85 166.41 6.43 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.058 -1.026 . . . . 0.0 110.397 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.496 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.9 p30 -89.22 67.27 7.86 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.641 -0.662 . . . . 0.0 110.835 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' C ' ' OD1' ' A' ' 22' ' ' ASP . 8.8 t0 -112.17 95.41 30.15 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.12 -41.65 33.65 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 122.207 1.938 . . . . 0.0 112.794 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -62.56 -40.03 95.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.908 -1.12 . . . . 0.0 108.752 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.577 HH22 ' CG ' ' A' ' 55' ' ' ASP . 63.1 ttt180 -59.69 -36.12 75.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 110.11 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -60.15 -52.94 63.17 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.403 -0.811 . . . . 0.0 109.354 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -52.65 -38.3 60.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.471 -0.768 . . . . 0.0 109.971 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -64.48 -59.74 3.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.081 -1.012 . . . . 0.0 110.81 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 50.7 mt -52.93 -47.91 67.7 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.041 -1.037 . . . . 0.0 108.791 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.426 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 30.1 m-20 -61.93 -45.14 95.01 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.418 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.1 -46.73 73.33 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.218 -0.926 . . . . 0.0 109.843 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.5 tp -57.21 -47.78 80.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.224 -0.922 . . . . 0.0 110.276 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.7 m-85 -61.89 -36.6 81.78 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.19 -1.404 . . . . 0.0 107.679 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -70.24 -53.12 18.31 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.564 -0.71 . . . . 0.0 109.975 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -59.2 -42.08 90.06 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.375 -0.828 . . . . 0.0 111.172 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mmm -57.23 -34.85 68.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.944 . . . . 0.0 110.443 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -54.63 -39.92 68.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 109.362 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -74.89 -30.21 61.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 108.793 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -65.72 -30.85 71.58 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.742 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.93 -0.63 69.78 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.5 p -116.68 84.48 15.4 Favored Pre-proline 0 N--CA 1.488 1.468 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -83.14 139.03 9.25 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 122.558 2.172 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.9 mt -73.75 96.76 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.091 -1.005 . . . . 0.0 110.246 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 81.9 m-20 -60.52 -33.99 73.44 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -158.98 139.24 12.24 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -70.92 125.37 92.0 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.032 -1.043 . . . . 0.0 110.157 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -53.21 139.52 62.99 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.576 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 8.7 mt -103.11 146.7 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.867 -1.146 . . . . 0.0 110.714 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.2 mmm -137.41 127.06 25.27 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 56.85 42.89 25.83 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.93 24.51 12.64 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.365 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -135.05 153.84 51.92 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.182 -0.949 . . . . 0.0 109.324 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.2 m -67.27 142.09 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 120.983 -1.073 . . . . 0.0 109.387 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 64.8 tp -75.16 123.48 25.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.307 -0.871 . . . . 0.0 110.012 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.577 ' CG ' HH22 ' A' ' 25' ' ' ARG . 38.5 m-20 -59.56 99.96 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.521 -0.737 . . . . 0.0 109.719 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.6 -30.32 71.25 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.074 -1.016 . . . . 0.0 109.234 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -80.85 -60.56 2.26 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.291 -0.881 . . . . 0.0 111.578 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -54.1 -38.16 65.07 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.666 -1.271 . . . . 0.0 108.584 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.95 -46.37 89.64 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE2' HG13 ' A' ' 64' ' ' ILE . 54.0 t80 -59.37 -66.38 0.52 Allowed 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 121.485 0.659 . . . . 0.0 109.731 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -42.92 -42.11 3.59 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.582 -0.699 . . . . 0.0 111.552 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.99 -43.63 64.78 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.059 -1.456 . . . . 0.0 108.066 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.407 HG22 ' CE2' ' A' ' 102' ' ' TYR . 36.1 t -58.98 -44.35 90.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.239 -0.913 . . . . 0.0 109.334 179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.41 HG13 ' CE2' ' A' ' 60' ' ' TYR . 15.7 mm -69.55 -38.72 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 120.738 -1.226 . . . . 0.0 108.403 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.89 -19.93 7.7 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.812 -0.555 . . . . 0.0 110.13 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.41 ' N ' ' HD2' ' A' ' 66' ' ' ARG . 7.0 mpt_? -95.06 -0.82 53.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.584 -1.323 . . . . 0.0 108.957 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.63 72.56 Favored Glycine 0 N--CA 1.492 2.404 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.263 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.1 131.52 2.46 Favored Glycine 0 N--CA 1.498 2.806 0 CA-C-N 119.722 1.761 . . . . 0.0 111.703 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 tp -52.64 -38.97 61.27 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.678 -0.895 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 77.8 t -56.15 -43.64 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.202 -0.936 . . . . 0.0 108.97 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -59.15 -40.2 84.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.166 -0.959 . . . . 0.0 110.025 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.595 ' O ' ' N ' ' A' ' 76' ' ' LYS . 60.5 t -63.64 -43.99 98.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 120.741 -1.224 . . . . 0.0 109.551 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 33.7 mt -65.04 -61.53 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 120.758 -1.214 . . . . 0.0 110.182 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -58.48 -41.38 85.17 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.156 -0.965 . . . . 0.0 110.764 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.412 ' HZ3' ' HB3' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -90.87 -10.03 44.13 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.95 -1.093 . . . . 0.0 110.261 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' VAL . 21.4 mtmm 58.69 60.66 2.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.29 -0.881 . . . . 0.0 110.951 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.0 mt -95.42 14.22 23.32 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.104 -0.998 . . . . 0.0 108.55 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' A' ' 82' ' ' ILE . 98.8 m95 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.36 -0.837 . . . . 0.0 109.03 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.445 ' C ' ' O ' ' A' ' 78' ' ' TRP . 80.5 mt-30 -48.13 -38.83 18.77 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.537 -1.352 . . . . 0.0 108.437 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.8 mm-40 -67.85 -38.61 83.35 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 178.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.3 mt -74.25 -51.41 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.505 ' N ' ' O ' ' A' ' 78' ' ' TRP . 57.3 mt -52.0 -56.05 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.49 -37.07 68.53 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.374 -0.829 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -51.85 -34.7 37.96 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.49 -4.92 55.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.373 -1.075 . . . . 0.0 109.039 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 65.72 38.98 5.01 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.642 0.734 . . . . 0.0 109.16 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.24 145.75 86.03 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.0 Cg_endo -71.06 136.68 30.11 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.281 1.987 . . . . 0.0 112.415 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 t -62.79 -0.7 0.7 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.435 ' H ' ' C ' ' A' ' 88' ' ' PRO . 77.9 p -64.64 -25.56 68.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.987 -1.07 . . . . 0.0 109.551 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.408 HG23 ' N ' ' A' ' 94' ' ' ALA . 68.5 mt -93.25 99.5 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.99 -1.069 . . . . 0.0 108.748 178.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 40.8 p -68.35 -31.12 70.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.108 -0.995 . . . . 0.0 108.851 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.477 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 58.4 m -88.07 29.25 0.96 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.408 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -59.23 -67.35 0.38 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.4 -0.813 . . . . 0.0 108.976 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.03 -47.54 33.51 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.644 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.8 -45.53 92.06 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.33 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 36.2 m -61.63 -39.75 92.41 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.02 -1.05 . . . . 0.0 108.616 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.8 mt -70.9 -43.99 67.19 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.509 -0.745 . . . . 0.0 109.725 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -66.24 -51.28 59.09 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.111 -0.993 . . . . 0.0 110.66 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.2 m -57.11 -54.69 43.91 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.552 -0.718 . . . . 0.0 110.996 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -62.61 -41.2 98.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.986 -1.071 . . . . 0.0 111.393 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.407 ' CE2' HG22 ' A' ' 63' ' ' VAL . 4.9 t80 -57.32 -41.63 80.29 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.545 -1.347 . . . . 0.0 109.344 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 35.3 ttm -53.81 -52.89 58.88 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.823 -0.548 . . . . 0.0 111.313 -178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -71.17 -54.84 9.62 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.811 -1.181 . . . . 0.0 112.732 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -84.86 -45.8 11.94 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -174.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 9.4 mp -97.4 -7.74 31.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.121 -1.612 . . . . 0.0 114.255 -175.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.634 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 26.6 t80 -57.94 -38.3 65.2 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 119.822 -1.799 . . . . 0.0 110.006 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 24.4 Cg_exo -65.0 -54.43 0.66 Allowed 'Trans proline' 0 N--CA 1.5 1.881 0 C-N-CA 122.513 2.142 . . . . 0.0 112.793 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.23 -44.07 88.04 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.178 -0.951 . . . . 0.0 108.64 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.33 -53.95 30.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 110.502 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.634 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 58.0 m -71.62 -45.09 63.11 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -0.868 . . . . 0.0 111.456 -177.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -67.67 -49.44 62.82 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.912 -1.117 . . . . 0.0 111.268 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -76.76 -23.79 52.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.995 -1.065 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -125.88 -30.96 2.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.81 -1.181 . . . . 0.0 111.416 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 111' ' ' CYS . 15.3 t30 56.32 47.02 19.96 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.92 -1.113 . . . . 0.0 110.226 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 48.5 mt -67.64 -30.28 69.8 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.003 -1.06 . . . . 0.0 111.114 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 32.1 t -153.94 -166.64 2.43 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.371 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 64.0 p -126.79 153.66 75.92 Favored Pre-proline 0 N--CA 1.497 1.903 0 O-C-N 121.711 -0.618 . . . . 0.0 109.984 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -52.08 -40.54 68.05 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.121 1.881 . . . . 0.0 112.188 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.27 89.35 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.769 -1.207 . . . . 0.0 109.727 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -65.84 -42.94 89.86 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.1 tp -65.69 -53.59 38.92 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.576 -0.702 . . . . 0.0 109.937 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -56.05 -44.37 78.78 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.55 75.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.54 -36.12 73.51 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.752 0.786 . . . . 0.0 108.954 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 34.0 mt -59.05 -52.89 55.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -67.0 -37.7 84.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.509 -0.744 . . . . 0.0 109.327 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.15 -30.11 72.89 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.698 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -95.82 -36.36 11.16 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.916 -1.344 . . . . 0.0 110.505 -178.893 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.698 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.7 mtp180 -63.84 145.38 55.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.85 -1.156 . . . . 0.0 110.295 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.536 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -66.21 144.83 56.39 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.655 -0.653 . . . . 0.0 109.334 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -108.43 -153.6 0.51 Allowed 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.343 -0.848 . . . . 0.0 108.807 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.686 -1.365 . . . . 0.0 109.686 -179.952 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.002 0 O4'-C1'-C2' 108.188 1.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.578 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.927 0 O4'-C1'-C2' 108.698 2.362 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.957 0 O4'-C4'-C3' 107.631 2.031 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.487 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O5'-C5'-C4' 113.197 2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.029 0 O5'-C5'-C4' 113.126 2.09 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.887 0 O5'-C5'-C4' 112.811 1.865 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.576 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.203 0 O4'-C4'-C3' 107.75 2.15 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.981 0 O4'-C4'-C3' 107.679 2.079 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.917 0 O4'-C1'-C2' 108.705 2.368 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O5'-C5'-C4' 113.125 2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.223 0 O5'-C5'-C4' 113.468 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.689 0 O5'-C5'-C4' 113.031 2.022 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C4'-C3' 107.385 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.972 2.372 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.44 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.424 0 O4'-C1'-C2' 107.558 1.325 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.44 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C1'-C2' 108.702 2.365 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.41 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.198 0 O5'-C5'-C4' 112.576 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.41 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.629 0 C4'-C3'-C2' 105.618 2.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.57 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C4'-C3' 107.843 2.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.477 ' O4 ' ' OG ' ' A' ' 93' ' ' SER . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O4'-C4'-C3' 107.725 2.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.019 0 O5'-C5'-C4' 113.438 2.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.929 0 O5'-C5'-C4' 113.386 2.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.826 0 O4'-C1'-C2' 108.777 2.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C4'-C3' 108.052 2.452 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.905 0 O4'-C4'-C3' 107.887 2.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.391 0 O4'-C4'-C3' 107.929 2.329 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.739 0 O4'-C4'-C3' 107.793 2.193 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.777 0 O4'-C4'-C3' 107.781 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C4'-C3' 107.703 2.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -113.9 78.93 1.19 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.419 -1.047 . . . . 0.0 108.71 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -109.62 140.92 42.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.534 -0.729 . . . . 0.0 109.987 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 6' ' ' PHE . 0.0 OUTLIER -57.28 -43.01 82.76 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.439 -0.788 . . . . 0.0 109.474 -179.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -63.32 -45.78 89.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.012 -1.055 . . . . 0.0 109.208 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -56.76 -39.94 74.94 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 108.615 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.562 ' NE2' ' C ' ' A' ' 44' ' ' ASN . 20.0 mm-40 -69.14 -37.78 78.48 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.483 -0.76 . . . . 0.0 109.038 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -55.15 -49.4 71.92 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.363 -0.836 . . . . 0.0 109.62 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -61.6 -38.73 88.68 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.92 -1.113 . . . . 0.0 109.176 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -65.21 -52.56 53.94 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.482 -0.761 . . . . 0.0 111.13 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -70.53 -35.95 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.989 -1.069 . . . . 0.0 109.62 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -60.05 -38.73 83.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.305 -1.497 . . . . 0.0 107.894 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.405 ' CA ' HE21 ' A' ' 15' ' ' GLN . 0.4 OUTLIER -58.93 -31.87 69.05 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 178.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.44 -36.41 81.16 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.436 -0.79 . . . . 0.0 110.964 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.463 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 81.5 m-85 -82.32 -38.62 24.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.375 -1.453 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.6 -30.25 71.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.067 -1.021 . . . . 0.0 111.032 -177.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.482 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 8.1 mt -38.02 -37.08 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 O-C-N 121.567 -0.708 . . . . 0.0 110.363 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.3 m120 -170.31 159.68 7.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.952 -1.093 . . . . 0.0 109.78 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.2 64.82 4.56 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.736 -0.603 . . . . 0.0 109.525 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.94 137.55 20.15 Favored Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -71.81 -61.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.029 1.819 . . . . 0.0 112.198 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -59.35 -37.84 78.89 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.224 -0.923 . . . . 0.0 109.649 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -56.84 -42.39 79.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.646 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -60.9 -54.23 47.65 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.154 -0.966 . . . . 0.0 108.834 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -53.42 -36.17 61.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.591 -0.693 . . . . 0.0 109.633 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -61.42 -62.91 1.49 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.344 -0.847 . . . . 0.0 110.816 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.4 mt -57.13 -44.45 83.36 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.515 -0.741 . . . . 0.0 109.55 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.463 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 30.6 m-20 -63.4 -45.9 88.9 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.352 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -66.43 -42.37 87.82 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.114 -0.991 . . . . 0.0 109.008 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.416 HD11 ' CD2' ' A' ' 109' ' ' TYR . 58.0 tp -57.97 -50.51 73.15 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.322 -0.861 . . . . 0.0 110.169 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -60.83 -34.08 74.01 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 117.988 -1.485 . . . . 0.0 107.971 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.5 m -68.88 -50.16 52.06 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.092 -1.005 . . . . 0.0 108.942 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.1 -43.27 95.7 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 111.103 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.7 mmm -58.22 -35.79 72.18 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.229 -0.92 . . . . 0.0 110.84 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -59.19 -40.33 85.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.695 -1.253 . . . . 0.0 108.853 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -64.73 -40.91 96.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.332 -0.855 . . . . 0.0 109.396 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.4 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -65.2 -30.11 70.98 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.898 -0.501 . . . . 0.0 110.412 -178.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 1.13 64.63 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 107.775 -2.13 . . . . 0.0 107.775 -178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.4 p -116.56 85.23 16.22 Favored Pre-proline 0 N--CA 1.488 1.434 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -83.53 148.47 12.72 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.733 2.289 . . . . 0.0 111.716 -179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.472 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 46.0 mt -87.52 101.42 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.037 -1.039 . . . . 0.0 110.195 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.562 ' C ' ' NE2' ' A' ' 9' ' ' GLN . 84.9 m-20 -85.95 -0.77 56.31 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.311 -0.868 . . . . 0.0 109.026 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.59 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -171.79 120.23 0.46 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.507 -0.745 . . . . 0.0 109.206 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.0 mt -72.09 118.9 71.21 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.054 -1.029 . . . . 0.0 109.316 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -49.72 128.29 20.94 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 N-CA-C 108.831 -1.257 . . . . 0.0 108.831 177.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.592 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 60.4 mt -95.71 144.19 10.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.134 -0.979 . . . . 0.0 110.608 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.411 ' N ' HG23 ' A' ' 48' ' ' ILE . 79.4 mtp -135.09 122.1 21.26 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.87 39.83 3.27 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 58.6 24.4 12.0 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.252 0.549 . . . . 0.0 110.247 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.2 p -136.64 152.75 50.77 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.189 -0.945 . . . . 0.0 109.445 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.9 m -67.39 144.99 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 120.973 -1.079 . . . . 0.0 109.216 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.3 tp -74.16 120.49 19.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 110.028 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -63.05 91.8 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.341 -0.85 . . . . 0.0 109.09 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.06 -26.22 59.99 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.145 -0.972 . . . . 0.0 110.096 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.444 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 44.3 t80 -81.02 -57.03 3.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.066 -1.021 . . . . 0.0 111.586 -178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.43 -37.87 79.21 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.564 -1.335 . . . . 0.0 109.411 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.3 tp -59.83 -45.99 90.65 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 43.3 t80 -57.26 -66.64 0.42 Allowed 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.522 0.677 . . . . 0.0 109.41 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 74.6 m-20 -41.43 -41.13 1.94 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.689 -0.632 . . . . 0.0 111.219 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.44 -43.14 64.2 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 118.234 -1.386 . . . . 0.0 107.689 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.4 HG22 ' CE2' ' A' ' 102' ' ' TYR . 43.7 t -59.39 -44.75 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.874 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.424 HG21 HD13 ' A' ' 64' ' ' ILE . 8.6 mm -69.51 -36.86 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.663 -1.273 . . . . 0.0 108.318 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.1 -22.81 11.88 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.848 -0.533 . . . . 0.0 110.27 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.463 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.0 mpt_? -92.93 -0.22 57.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.614 -1.304 . . . . 0.0 108.753 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.98 17.99 68.55 Favored Glycine 0 N--CA 1.49 2.252 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.818 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 141.24 129.38 2.48 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 120.548 -1.56 . . . . 0.0 111.259 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.6 tp -50.36 -40.64 49.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.677 -0.896 . . . . 0.0 110.361 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.2 t -57.75 -42.14 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.861 -1.149 . . . . 0.0 109.871 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -55.94 -40.12 72.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.914 -1.116 . . . . 0.0 108.909 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 94.0 t -65.06 -41.29 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 110.157 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.47 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 49.3 mt -67.59 -56.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 O-C-N 120.775 -1.203 . . . . 0.0 109.734 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -57.69 -42.03 82.84 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.136 -0.977 . . . . 0.0 110.184 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -92.23 -10.21 39.38 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.253 -0.904 . . . . 0.0 110.452 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 3.5 mtmp? 58.54 59.08 3.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.385 -0.822 . . . . 0.0 110.05 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.1 mt -90.88 15.37 11.46 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.014 -1.054 . . . . 0.0 108.545 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.693 ' HE1' HH12 ' A' ' 99' ' ' ARG . 99.0 m95 -63.26 -37.56 87.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 108.923 178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.509 ' NE2' ' H ' ' A' ' 79' ' ' GLN . 3.6 mp0 -48.9 -40.82 31.35 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.439 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.511 ' O ' ' N ' ' A' ' 84' ' ' GLY . 81.3 mm-40 -69.05 -38.85 79.34 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt -71.28 -53.46 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.416 ' N ' ' O ' ' A' ' 78' ' ' TRP . 76.3 mt -53.19 -52.83 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -73.58 -40.29 64.0 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.292 -0.88 . . . . 0.0 109.889 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.05 -34.18 46.06 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' C ' ' CD2' ' A' ' 86' ' ' HIS . 87.7 mt -88.48 -7.2 56.94 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.287 -1.125 . . . . 0.0 108.886 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.448 ' CD2' ' C ' ' A' ' 85' ' ' LEU . 12.8 m-70 69.15 36.67 2.34 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.576 0.703 . . . . 0.0 109.245 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -73.3 121.01 84.06 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.359 -0.838 . . . . 0.0 109.198 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.493 ' C ' ' H ' ' A' ' 90' ' ' SER . 45.9 Cg_exo -50.08 139.62 34.06 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.669 1.579 . . . . 0.0 112.23 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 p -63.44 0.87 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 109.619 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.493 ' H ' ' C ' ' A' ' 88' ' ' PRO . 89.1 p -65.04 -24.49 67.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.935 -178.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.421 HG22 ' N ' ' A' ' 94' ' ' ALA . 86.6 mt -95.72 98.43 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.948 -1.095 . . . . 0.0 108.894 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.411 ' HG1' ' H62' ' B' ' 410' ' ' ' DA' . 30.6 p -68.36 -28.51 67.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -0.92 . . . . 0.0 108.803 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.8 m -90.5 30.54 1.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.421 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -62.26 -65.9 0.62 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.855 . . . . 0.0 108.986 -179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.92 -50.7 33.95 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 109.179 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.03 -45.66 86.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.851 -1.156 . . . . 0.0 108.978 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.9 m -60.67 -40.02 90.56 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.174 -0.954 . . . . 0.0 108.845 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -72.56 -44.49 62.02 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.452 -0.78 . . . . 0.0 110.152 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.693 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.6 ttm-85 -65.99 -52.86 45.65 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.176 -0.953 . . . . 0.0 110.739 -179.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.1 m -57.05 -52.73 64.11 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.43 -0.794 . . . . 0.0 110.778 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -62.34 -40.67 97.13 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.127 -0.983 . . . . 0.0 111.142 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.4 ' CE2' HG22 ' A' ' 63' ' ' VAL . 3.4 t80 -57.92 -39.49 78.1 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 120.55 -1.344 . . . . 0.0 109.038 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.9 ttm -53.96 -56.49 17.34 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.548 -0.72 . . . . 0.0 111.877 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -72.42 -52.18 17.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.479 -1.388 . . . . 0.0 113.032 -176.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -85.33 -50.96 6.9 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -174.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.448 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 10.0 mp -96.52 6.05 49.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.338 -1.476 . . . . 0.0 113.751 -176.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.598 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 78.0 t80 -68.42 -37.15 9.83 Favored Pre-proline 0 C--N 1.3 -1.545 0 O-C-N 120.013 -1.68 . . . . 0.0 111.666 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.1 Cg_endo -80.28 -39.52 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.333 1.356 . . . . 0.0 111.688 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.416 ' CD2' HD11 ' A' ' 32' ' ' LEU . 13.6 t80 -59.47 -39.84 84.99 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -72.68 -53.91 10.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.482 -0.761 . . . . 0.0 109.909 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.59 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.8 t -70.56 -44.25 67.81 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.294 -0.879 . . . . 0.0 110.739 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.3 tp10 -66.79 -47.87 70.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 120.759 -1.213 . . . . 0.0 110.851 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -75.97 -28.17 57.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 111.158 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 44.3 tptt -125.32 -26.55 3.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.064 -1.022 . . . . 0.0 111.811 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.5 OUTLIER 57.72 45.67 18.5 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.644 -1.285 . . . . 0.0 110.048 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 75.6 mt -68.4 -32.61 72.79 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.203 -0.935 . . . . 0.0 110.958 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.711 ' HG ' ' H ' ' A' ' 118' ' ' THR . 42.9 t -155.79 -166.93 2.34 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.633 -1.227 . . . . 0.0 111.94 -178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.711 ' H ' ' HG ' ' A' ' 117' ' ' SER . 70.5 p -120.55 153.65 56.53 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -179.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.598 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 14.7 Cg_endo -59.35 -38.17 86.09 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.876 1.717 . . . . 0.0 112.186 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.07 85.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.051 -1.031 . . . . 0.0 109.319 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.505 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.9 mt-10 -66.81 -42.73 85.4 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.47 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 11.5 tp -64.74 -52.85 54.87 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 109.431 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -57.89 -46.43 84.92 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.201 -0.937 . . . . 0.0 109.065 178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.8 -42.72 98.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.38 -0.825 . . . . 0.0 110.152 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.53 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.061 -1.024 . . . . 0.0 108.342 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 4.1 mt -65.47 -49.25 79.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 130' ' ' ARG . 89.8 m-20 -61.09 -38.3 85.78 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.66 -30.87 78.1 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.66 ' C ' HD21 ' A' ' 129' ' ' ASN . 0.0 OUTLIER -90.59 -34.28 15.55 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.981 -1.305 . . . . 0.0 110.902 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.66 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 67.6 mtm180 -61.6 149.85 37.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.625 -1.297 . . . . 0.0 109.513 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.526 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -69.53 137.62 52.63 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.513 -0.742 . . . . 0.0 109.749 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -85.49 0.61 51.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.868 . . . . 0.0 108.958 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.999 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.024 0 O4'-C1'-C2' 108.344 2.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.551 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.226 0 O4'-C1'-C2' 108.711 2.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.855 0 O4'-C4'-C3' 107.563 1.963 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.93 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.197 0 O4'-C4'-C3' 107.536 1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.154 0 O5'-C5'-C4' 113.196 2.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . 0.551 ' OP2' ' NH2' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.812 0 O4'-C4'-C3' 107.618 2.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.592 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.608 1.464 0 O4'-C1'-C2' 108.515 2.196 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.981 0 O5'-C5'-C4' 112.915 1.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . 0.411 ' H62' ' HG1' ' A' ' 92' ' ' THR . . . . . . . . 0 P--O5' 1.613 2.009 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.674 0 O5'-C5'-C4' 113.267 2.191 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.748 0 O4'-C4'-C3' 107.834 2.234 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.696 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O5'-C5'-C4' 112.629 1.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O4'-C4'-C3' 107.899 2.299 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.43 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -2.009 0 O4'-C1'-C2' 107.794 1.54 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.43 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.14 0 O4'-C1'-C2' 108.785 2.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.275 0 O5'-C5'-C4' 112.538 1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.411 ' OP1' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 P--O5' 1.609 1.559 0 O5'-C5'-C4' 113.621 2.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.573 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.866 0 O4'-C4'-C3' 107.833 2.233 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O5'-C5'-C4' 113.194 2.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.24 0 O5'-C5'-C4' 113.488 2.349 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O5'-C5'-C4' 113.529 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C1'-C2' 108.747 2.406 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.514 0 O5'-C5'-C4' 113.736 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.385 0 O4'-C4'-C3' 107.482 1.882 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.663 0 O4'-C4'-C3' 107.749 2.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.784 0 O5'-C5'-C4' 113.008 2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.942 0 O5'-C5'-C4' 113.316 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.708 0 O4'-C4'-C3' 107.573 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.592 ' O ' ' N ' ' A' ' 5' ' ' SER . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.449 ' C ' ' O ' ' A' ' 3' ' ' GLY . 55.6 t90 -39.45 91.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.43 -1.041 . . . . 0.0 109.79 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 3' ' ' GLY . 0.3 OUTLIER -110.69 140.59 44.92 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.523 -0.736 . . . . 0.0 109.448 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -55.49 -40.14 71.32 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.476 -0.765 . . . . 0.0 110.339 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -64.7 -42.36 95.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.919 -1.113 . . . . 0.0 109.587 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -57.77 -39.26 77.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.815 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.6 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.9 mm-40 -71.23 -37.46 72.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.277 -0.889 . . . . 0.0 109.011 179.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.3 -49.57 66.72 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.88 . . . . 0.0 109.768 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -61.56 -37.61 84.47 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.162 -0.961 . . . . 0.0 109.275 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -65.77 -53.32 42.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.166 -0.959 . . . . 0.0 110.956 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -72.76 -36.16 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.995 -1.066 . . . . 0.0 109.707 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -60.99 -40.99 95.57 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.261 -1.524 . . . . 0.0 108.421 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -59.05 -30.73 68.26 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.231 -0.918 . . . . 0.0 108.733 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.0 mt -67.31 -33.88 76.19 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.922 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.589 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 68.8 m-85 -83.96 -40.9 17.91 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.636 -1.29 . . . . 0.0 110.723 -179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.8 mm-40 -57.42 -32.23 66.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.054 -1.029 . . . . 0.0 109.322 -177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 5.2 mt -44.62 -43.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 O-C-N 121.423 -0.798 . . . . 0.0 109.721 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 3.9 m120 -178.04 123.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.123 -0.986 . . . . 0.0 109.781 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.495 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 51.6 p30 -86.1 68.78 10.4 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.554 -0.716 . . . . 0.0 110.789 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.4 130.94 39.84 Favored Pre-proline 0 C--N 1.303 -1.414 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -40.08 -64.16 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 C-N-CA 122.118 1.879 . . . . 0.0 112.984 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -63.89 -39.26 93.78 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.705 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -59.78 -45.99 90.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.845 -1.16 . . . . 0.0 110.38 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -61.0 -47.46 86.34 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.829 -1.17 . . . . 0.0 108.697 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.514 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 84.9 tt0 -53.03 -27.68 20.8 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.389 0.614 . . . . 0.0 109.784 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -71.89 -61.68 1.7 Allowed 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.114 -0.991 . . . . 0.0 111.33 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.522 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 13.6 mt -60.27 -44.68 95.11 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.383 -0.823 . . . . 0.0 111.057 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.589 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 40.9 p-10 -64.37 -46.02 85.17 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 118.931 -1.107 . . . . 0.0 109.579 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.589 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 52.5 t0 -65.74 -43.54 88.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.289 -0.882 . . . . 0.0 109.445 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -54.63 -49.09 71.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.188 -0.945 . . . . 0.0 109.578 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.522 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 51.5 m-85 -62.1 -34.62 76.67 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.75 -1.18 . . . . 0.0 107.856 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -69.3 -55.41 10.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.536 -0.728 . . . . 0.0 110.44 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 39.2 t80 -60.52 -38.3 83.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.282 -0.886 . . . . 0.0 110.929 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.4 mmm -60.15 -36.21 77.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.007 . . . . 0.0 110.946 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -57.91 -41.2 82.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.052 . . . . 0.0 110.335 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -65.01 -37.78 88.78 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.633 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -64.48 -30.11 71.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.837 -178.637 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.36 1.21 64.59 Favored Glycine 0 N--CA 1.482 1.742 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 41.9 p -114.43 84.3 9.5 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -85.11 143.16 9.01 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.514 2.143 . . . . 0.0 110.767 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 53.5 mt -80.68 99.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 120.944 -1.098 . . . . 0.0 110.008 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 80.9 m-20 -64.48 -46.83 81.35 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -138.22 133.2 32.9 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.69 147.47 94.5 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 120.84 -1.163 . . . . 0.0 109.182 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.33 106.64 1.8 Allowed 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 121.556 1.504 . . . . 0.0 109.875 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.581 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 40.6 mt -77.15 142.55 14.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.131 -0.98 . . . . 0.0 109.947 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 69.0 mmm -134.08 127.08 31.45 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.87 42.6 16.17 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 59.65 25.61 14.57 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.205 0.526 . . . . 0.0 110.409 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 95.3 p -138.02 153.53 49.37 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.129 -0.982 . . . . 0.0 109.758 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.2 m -66.88 145.07 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.027 -1.046 . . . . 0.0 109.178 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 46.1 tp -79.7 125.31 29.48 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.366 -0.834 . . . . 0.0 109.999 -179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -68.35 89.6 0.34 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.404 -0.81 . . . . 0.0 109.301 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -52.03 -22.68 4.27 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.313 -0.867 . . . . 0.0 109.595 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.545 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 48.7 t80 -77.72 -55.38 5.39 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.06 -1.025 . . . . 0.0 111.66 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -61.81 -39.94 93.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.765 -1.209 . . . . 0.0 110.44 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 52.6 tp -59.55 -43.45 93.52 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 120.732 -1.23 . . . . 0.0 108.263 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE2' HG13 ' A' ' 64' ' ' ILE . 50.2 t80 -59.29 -66.75 0.46 Allowed 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.484 0.659 . . . . 0.0 109.653 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 71.8 m-20 -42.54 -39.48 2.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.61 -0.681 . . . . 0.0 110.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.47 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.6 mt -72.5 -44.74 61.84 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.448 -1.301 . . . . 0.0 107.851 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 102' ' ' TYR . 40.8 t -58.8 -45.49 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.135 -0.978 . . . . 0.0 110.16 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.408 HD11 HG23 ' A' ' 64' ' ' ILE . 7.7 mm -67.72 -35.5 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.681 -1.262 . . . . 0.0 108.412 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.431 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.85 -25.15 26.79 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 120.261 -0.575 . . . . 0.0 110.073 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.566 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.8 mpt_? -91.17 -2.79 57.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.574 -1.329 . . . . 0.0 108.953 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.74 18.72 61.1 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.14 178.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.68 133.6 3.15 Favored Glycine 0 N--CA 1.501 3.031 0 CA-C-N 119.297 1.548 . . . . 0.0 111.41 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.9 tp -51.13 -39.01 55.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.727 -0.866 . . . . 0.0 110.305 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.94 -43.3 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.037 -1.04 . . . . 0.0 109.543 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -58.05 -39.57 78.8 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.991 -1.068 . . . . 0.0 110.171 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 76' ' ' LYS . 52.2 t -64.13 -43.58 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.38 -0.825 . . . . 0.0 110.291 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.419 HG22 HD11 ' A' ' 73' ' ' ILE . 80.8 mt -66.03 -57.92 8.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 O-C-N 120.655 -1.278 . . . . 0.0 110.249 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -58.26 -41.34 84.05 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.174 -0.954 . . . . 0.0 110.415 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -92.61 -9.09 42.29 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.144 -0.973 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.0 mttp 57.67 57.3 4.34 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 -178.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.7 mt -90.71 15.48 11.0 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 120.951 -1.093 . . . . 0.0 108.244 178.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.427 ' O ' ' C ' ' A' ' 79' ' ' GLN . 91.4 m95 -65.69 -40.27 92.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.5 -0.75 . . . . 0.0 109.121 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.545 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 5.4 mp0 -49.11 -38.71 25.63 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.389 -1.324 . . . . 0.0 108.16 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.566 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.7 mt-10 -69.76 -41.27 75.39 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.21 -52.69 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 72.0 mt -50.95 -56.57 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.557 -0.714 . . . . 0.0 109.139 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -70.22 -37.23 74.99 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.169 -0.957 . . . . 0.0 110.087 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.95 -32.73 34.94 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.0 mt -92.21 -7.07 49.32 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.365 -1.08 . . . . 0.0 109.135 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 68.09 40.97 2.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.746 -0.596 . . . . 0.0 110.122 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.27 140.45 85.21 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.102 -0.999 . . . . 0.0 108.844 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 44.3 Cg_endo -70.69 141.57 41.76 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 122.181 1.92 . . . . 0.0 112.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.8 p -55.83 -0.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.399 -0.813 . . . . 0.0 109.845 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 84.4 p -66.51 -26.82 67.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.168 -0.958 . . . . 0.0 109.947 -178.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.439 HD12 HG23 ' A' ' 91' ' ' ILE . 80.3 mt -98.68 102.93 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.86 -1.15 . . . . 0.0 109.353 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.3 p -74.73 -27.79 60.51 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.044 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.5 m -94.2 37.82 1.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.475 -0.766 . . . . 0.0 109.196 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.69 -65.09 0.74 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.32 -0.862 . . . . 0.0 108.903 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -47.62 -51.7 20.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -0.894 . . . . 0.0 109.619 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.481 ' O ' ' OG1' ' A' ' 100' ' ' THR . 5.8 tp -58.73 -43.89 90.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.934 -1.104 . . . . 0.0 109.173 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -62.69 -41.22 99.0 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.036 -1.04 . . . . 0.0 108.827 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.61 -43.08 81.31 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.428 -0.795 . . . . 0.0 109.509 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.707 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.7 ttm180 -68.62 -51.45 42.13 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.338 -0.851 . . . . 0.0 111.291 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.481 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.2 m -55.17 -52.32 63.69 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.195 -0.941 . . . . 0.0 110.009 -178.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -62.87 -42.09 99.63 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.201 -0.937 . . . . 0.0 111.377 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.42 ' CE2' HG22 ' A' ' 63' ' ' VAL . 2.6 t80 -58.55 -42.23 87.41 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.453 -1.404 . . . . 0.0 110.074 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.2 ttm -53.36 -54.79 31.46 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.377 -0.827 . . . . 0.0 111.253 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -73.45 -54.71 7.61 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.936 -1.102 . . . . 0.0 113.068 -176.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -84.07 -46.39 12.03 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.479 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.1 mp -96.02 -5.9 40.02 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.189 -1.569 . . . . 0.0 113.631 -176.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.661 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 83.2 t80 -59.89 -37.01 44.65 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 119.966 -1.708 . . . . 0.0 110.123 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.637 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 13.4 Cg_exo -69.03 -52.86 0.35 Allowed 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.378 2.052 . . . . 0.0 112.501 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -59.91 -42.52 94.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.408 -0.807 . . . . 0.0 109.587 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -69.42 -51.53 35.52 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.35 -0.844 . . . . 0.0 110.324 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.661 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 71.4 m -70.8 -42.36 70.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.348 -0.845 . . . . 0.0 110.49 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -66.81 -51.48 55.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.837 -1.164 . . . . 0.0 111.149 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -74.28 -26.12 60.01 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.035 -1.04 . . . . 0.0 111.408 -178.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.5 tptt -125.76 -29.73 3.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.977 -1.077 . . . . 0.0 111.607 -177.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.554 ' N ' ' O ' ' A' ' 111' ' ' CYS . 37.4 t30 55.96 45.82 23.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.685 -1.259 . . . . 0.0 109.885 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 53.3 mt -66.77 -33.14 74.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.267 -0.895 . . . . 0.0 111.174 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.496 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 10.7 t -155.57 -161.09 1.11 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 118.893 -1.123 . . . . 0.0 111.341 -178.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.468 ' H ' ' HG ' ' A' ' 117' ' ' SER . 71.1 p -125.53 164.22 33.85 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.738 -0.601 . . . . 0.0 109.66 -179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.495 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 16.5 Cg_exo -64.54 -36.14 44.63 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.549 1.499 . . . . 0.0 111.873 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.29 82.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.098 -1.001 . . . . 0.0 109.356 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 48.3 mt-10 -67.33 -45.22 77.06 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.403 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 14.7 tp -66.2 -50.87 62.38 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.486 -0.759 . . . . 0.0 109.501 178.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -59.05 -46.17 88.9 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.098 -1.001 . . . . 0.0 109.311 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.73 97.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.373 -0.829 . . . . 0.0 110.381 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.69 73.63 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.508 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.1 mt -66.63 -51.16 59.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.08 -39.52 94.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.467 -0.77 . . . . 0.0 109.791 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -30.56 72.16 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.707 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 28.6 p30 -89.57 -24.99 21.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.335 -1.097 . . . . 0.0 110.299 -178.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.614 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -62.83 141.13 58.77 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.998 -1.064 . . . . 0.0 109.595 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.518 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.4 mpt_? -66.35 150.26 49.14 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.428 -0.795 . . . . 0.0 110.014 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.94 -20.68 58.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.43 -0.794 . . . . 0.0 109.336 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.889 " O5'" ' H6 ' ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C1'-C2' 108.833 2.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.088 0 O4'-C4'-C3' 107.962 2.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.981 0 O4'-C4'-C3' 107.452 1.852 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.212 0 O5'-C5'-C4' 113.288 2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.955 0 O5'-C5'-C4' 113.087 2.062 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.022 0 O4'-C4'-C3' 107.668 2.068 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.675 0 O4'-C4'-C3' 107.656 2.056 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.581 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.194 0 O4'-C1'-C2' 108.426 2.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.254 0 O5'-C5'-C4' 113.251 2.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.127 0 O4'-C4'-C3' 107.826 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.849 0 O5'-C5'-C4' 112.995 1.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.157 0 O4'-C4'-C3' 107.835 2.235 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.018 0 O4'-C4'-C3' 107.692 2.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.976 0 O4'-C4'-C3' 107.413 1.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.023 0 O4'-C4'-C3' 107.901 2.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.438 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.422 -2.209 0 C4'-C3'-C2' 104.618 1.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.438 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.133 0 O4'-C1'-C2' 108.726 2.387 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.511 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.006 0 O5'-C5'-C4' 112.56 1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.511 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.792 0 O5'-C5'-C4' 113.788 2.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.795 0 O4'-C4'-C3' 107.686 2.086 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.406 ' C7 ' ' CD2' ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.805 0 O4'-C4'-C3' 107.772 2.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.67 0 O5'-C5'-C4' 113.336 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.781 0 O5'-C5'-C4' 113.613 2.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.055 0 O4'-C1'-C2' 108.83 2.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.097 0 O4'-C4'-C3' 107.93 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C4'-C3' 107.693 2.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.238 0 O4'-C4'-C3' 107.923 2.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.738 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.844 0 O4'-C4'-C3' 107.8 2.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.753 0 O4'-C4'-C3' 107.381 1.781 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.602 ' CH2' ' ND2' ' A' ' 44' ' ' ASN . 33.6 p90 -76.24 142.25 41.48 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.234 -1.157 . . . . 0.0 109.566 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.14 135.41 39.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 109.613 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -54.62 -36.72 64.8 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.398 -0.814 . . . . 0.0 110.036 -178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -64.51 -41.71 96.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.949 -1.094 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -54.4 -43.85 71.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.908 . . . . 0.0 109.719 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.451 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 47.8 mt-30 -69.59 -37.11 76.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.0 -1.063 . . . . 0.0 109.81 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -48.56 -49.28 37.19 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 109.791 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -61.76 -40.04 93.75 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.418 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -67.42 -53.24 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.368 -0.833 . . . . 0.0 111.549 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.1 p -69.69 -38.72 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.038 -1.039 . . . . 0.0 110.197 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -60.72 -39.28 88.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.125 -1.61 . . . . 0.0 108.258 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -29.44 65.89 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.229 -0.92 . . . . 0.0 108.68 178.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.6 mt -69.75 -40.22 76.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.44 -0.787 . . . . 0.0 111.464 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.455 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 91.4 m-85 -75.22 -36.83 61.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.402 -1.436 . . . . 0.0 109.864 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.481 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -62.32 -28.13 69.52 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 110.81 -177.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.481 ' C ' ' O ' ' A' ' 18' ' ' GLU . 23.3 mt -37.43 -41.42 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 O-C-N 121.602 -0.686 . . . . 0.0 110.738 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.588 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.82 168.18 5.08 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.733 -1.229 . . . . 0.0 110.598 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -90.97 65.5 5.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.614 -0.678 . . . . 0.0 110.526 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.65 137.3 20.21 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.201 -0.937 . . . . 0.0 108.563 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.88 -61.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.078 1.852 . . . . 0.0 112.262 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -34.89 71.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.132 -0.98 . . . . 0.0 109.581 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.501 HH22 ' CG ' ' A' ' 55' ' ' ASP . 59.6 ttt180 -58.48 -42.22 87.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.179 -0.95 . . . . 0.0 110.166 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -60.29 -53.29 59.36 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.86 -1.136 . . . . 0.0 108.482 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.22 -35.55 60.05 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.567 -0.708 . . . . 0.0 109.244 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -64.45 -61.84 1.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.448 -0.783 . . . . 0.0 110.995 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.7 mt -55.07 -46.96 75.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.915 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.455 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 39.1 m-20 -62.65 -46.64 87.29 Favored 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.492 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -67.17 -43.59 81.86 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.018 -1.051 . . . . 0.0 109.448 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.9 tp -56.32 -50.59 71.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 -179.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -61.78 -34.13 75.32 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.108 -1.437 . . . . 0.0 107.709 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.4 m -69.51 -53.02 21.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 109.553 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.41 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 60.0 t80 -59.14 -44.0 92.05 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.499 -0.751 . . . . 0.0 110.304 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 73.4 mmm -59.03 -37.46 77.03 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.666 -0.646 . . . . 0.0 110.462 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -59.39 -41.53 89.59 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.095 -1.003 . . . . 0.0 109.97 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.62 -46.34 79.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.469 HH11 ' HB2' ' A' ' 108' ' ' PRO . 2.8 mtp180 -62.59 -23.68 67.16 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.336 -0.852 . . . . 0.0 110.719 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.41 2.08 60.45 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 68.2 p -117.24 83.36 15.72 Favored Pre-proline 0 N--CA 1.493 1.693 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -86.98 145.62 7.58 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.987 2.458 . . . . 0.0 111.7 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.451 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 47.6 mt -79.86 98.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.082 -1.011 . . . . 0.0 109.142 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.602 ' ND2' ' CH2' ' A' ' 4' ' ' TRP . 19.8 m120 -63.14 -45.14 93.35 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -138.51 134.91 34.53 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.0 mt -70.93 144.62 90.64 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.816 -1.178 . . . . 0.0 109.463 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.78 116.29 4.66 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 121.587 1.524 . . . . 0.0 109.425 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.608 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 52.7 mt -82.59 144.19 10.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.001 -1.062 . . . . 0.0 110.061 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.417 ' N ' HG21 ' A' ' 48' ' ' ILE . 46.9 mmm -139.59 124.97 19.06 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.7 41.06 3.09 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.3 mttm 59.16 22.69 10.89 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.342 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.5 p -140.02 157.43 45.68 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.987 -1.071 . . . . 0.0 110.133 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.7 m -66.73 144.3 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 120.964 -1.085 . . . . 0.0 109.019 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.0 tp -78.63 124.07 27.79 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.364 -0.835 . . . . 0.0 109.767 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.501 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.0 m-20 -65.74 90.68 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.441 -0.787 . . . . 0.0 109.246 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 mt -55.44 -23.85 27.53 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.075 -1.016 . . . . 0.0 109.186 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -80.31 -57.94 3.37 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.179 -0.951 . . . . 0.0 111.58 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.7 -38.78 79.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.55 -1.344 . . . . 0.0 108.88 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.7 tp -58.18 -46.2 86.16 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.403 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.5 t80 -59.45 -66.18 0.55 Allowed 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.453 0.644 . . . . 0.0 109.303 178.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -42.04 -40.77 2.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.508 -0.745 . . . . 0.0 110.571 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.1 mt -71.69 -45.73 60.97 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.011 -1.476 . . . . 0.0 107.797 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.435 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.3 t -56.18 -45.07 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.137 -0.977 . . . . 0.0 110.253 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.416 HG21 HD11 ' A' ' 64' ' ' ILE . 9.7 mm -67.99 -35.98 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.665 -1.272 . . . . 0.0 107.894 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.31 -20.79 45.93 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.621 HH21 ' CB ' ' A' ' 80' ' ' GLU . 21.2 mmt-85 -93.88 0.81 56.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.579 -1.326 . . . . 0.0 108.443 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.39 13.62 73.12 Favored Glycine 0 N--CA 1.492 2.395 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.981 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.42 135.92 3.42 Favored Glycine 0 N--CA 1.502 3.058 0 CA-C-N 119.366 1.583 . . . . 0.0 111.391 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.0 tp -52.42 -39.62 61.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.553 -0.969 . . . . 0.0 110.374 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 85.3 t -58.74 -45.1 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.02 -1.05 . . . . 0.0 109.772 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.33 -39.16 69.65 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.029 -1.045 . . . . 0.0 108.651 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.8 t -63.94 -41.23 91.84 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.506 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.401 HG12 ' NH1' ' A' ' 99' ' ' ARG . 64.0 mt -66.96 -61.86 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 O-C-N 120.82 -1.175 . . . . 0.0 110.384 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -57.73 -40.16 78.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.192 -0.942 . . . . 0.0 110.215 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -91.61 -11.63 36.6 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.172 -0.955 . . . . 0.0 110.685 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.1 mtmt 58.73 60.11 2.64 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -178.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -94.63 14.44 21.03 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.935 -1.103 . . . . 0.0 108.773 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.427 ' O ' ' C ' ' A' ' 79' ' ' GLN . 81.6 m95 -62.97 -39.52 94.95 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.124 -0.985 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 78' ' ' TRP . 95.4 mm-40 -48.85 -39.39 25.46 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.379 -1.451 . . . . 0.0 108.371 178.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.621 ' CB ' HH21 ' A' ' 66' ' ' ARG . 79.0 mm-40 -66.25 -39.93 89.84 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.406 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -73.67 -50.55 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.553 -0.717 . . . . 0.0 109.211 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.404 ' N ' ' O ' ' A' ' 78' ' ' TRP . 79.7 mt -51.8 -54.02 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.509 -0.744 . . . . 0.0 109.5 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.41 -38.9 68.28 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.037 -1.04 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.74 -32.37 40.04 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.3 mt -90.47 -7.05 54.03 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.393 -1.063 . . . . 0.0 109.156 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 65.85 40.44 4.22 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.838 -0.539 . . . . 0.0 110.633 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.73 141.5 82.37 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 108.483 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.579 ' C ' ' H ' ' A' ' 90' ' ' SER . 57.6 Cg_endo -73.32 143.66 35.53 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.055 1.837 . . . . 0.0 112.532 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.7 m -58.06 1.42 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.356 -0.84 . . . . 0.0 109.664 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.579 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.6 p -66.57 -24.56 66.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.186 -0.947 . . . . 0.0 109.966 -178.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.41 HD11 HG23 ' A' ' 91' ' ' ILE . 81.6 mt -103.06 107.09 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 120.989 -1.069 . . . . 0.0 109.412 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.3 p -76.48 -28.15 56.36 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 108.729 179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 97' ' ' THR . 46.9 m -90.26 30.95 1.04 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.531 -0.731 . . . . 0.0 109.36 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.24 -64.74 0.85 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -50.57 -52.73 36.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 0.0 109.409 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.96 -44.71 91.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.825 -1.172 . . . . 0.0 108.884 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 93' ' ' SER . 55.1 m -59.06 -40.87 86.46 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 13.9 mt -68.75 -42.23 77.83 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.616 -0.678 . . . . 0.0 109.266 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.463 ' HG3' HH11 ' A' ' 99' ' ' ARG . 11.1 ttm-85 -65.05 -52.37 56.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.123 -0.986 . . . . 0.0 110.415 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.5 m -57.32 -53.65 55.67 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.429 -0.794 . . . . 0.0 110.341 -178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -64.79 -44.53 89.67 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.831 -1.168 . . . . 0.0 112.178 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.435 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.7 t80 -57.91 -40.12 79.62 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.087 -1.633 . . . . 0.0 108.783 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.583 ' SD ' ' CD2' ' A' ' 122' ' ' LEU . 55.8 mmm -52.55 -58.86 5.43 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.67 -0.644 . . . . 0.0 111.909 -179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -73.76 -50.8 18.89 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.559 -1.338 . . . . 0.0 112.818 -176.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -83.97 -48.53 9.86 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.9 mp -99.39 6.04 46.18 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.255 -1.528 . . . . 0.0 113.819 -176.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.528 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 36.0 t80 -66.58 -38.84 21.27 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.042 -1.661 . . . . 0.0 111.09 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.533 ' O ' ' N ' ' A' ' 112' ' ' GLU . 73.2 Cg_endo -78.64 -41.55 0.25 Allowed 'Trans proline' 0 N--CA 1.487 1.145 0 C-N-CA 121.472 1.448 . . . . 0.0 112.568 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.78 -42.62 89.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.85 -1.156 . . . . 0.0 108.348 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.96 -43.56 62.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.436 -0.79 . . . . 0.0 110.035 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.586 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.8 t -79.95 -46.27 17.01 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.1 -1.0 . . . . 0.0 110.927 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.8 tp10 -66.34 -45.62 79.6 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.737 -1.227 . . . . 0.0 110.634 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -75.34 -35.37 61.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.115 -0.99 . . . . 0.0 110.965 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -118.39 -27.15 6.06 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.012 -1.055 . . . . 0.0 111.876 -177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 111' ' ' CYS . 36.6 t-20 55.08 45.48 26.11 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.748 -1.22 . . . . 0.0 110.474 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 68.2 mt -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.105 -0.997 . . . . 0.0 110.561 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.477 ' OG ' ' N ' ' A' ' 118' ' ' THR . 37.8 t -153.02 -167.03 2.61 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.153 -1.019 . . . . 0.0 111.056 -178.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.477 ' N ' ' OG ' ' A' ' 117' ' ' SER . 65.5 p -127.32 159.12 67.02 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.574 -0.704 . . . . 0.0 110.171 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -55.97 -41.94 71.89 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.691 1.594 . . . . 0.0 112.665 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.6 91.81 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.878 -1.139 . . . . 0.0 109.754 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.55 -44.37 82.51 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.583 ' CD2' ' SD ' ' A' ' 103' ' ' MET . 15.2 tp -66.55 -52.41 45.93 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.664 -0.648 . . . . 0.0 110.251 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -57.64 -46.18 84.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.055 -1.028 . . . . 0.0 109.554 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.78 87.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.85 -34.55 76.92 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.285 -0.885 . . . . 0.0 108.75 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.539 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.4 mt -66.25 -49.09 78.59 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -61.68 -38.24 87.07 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.069 -1.019 . . . . 0.0 108.709 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.59 -28.71 73.57 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.9 p-10 -89.92 -30.19 18.02 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.694 -1.474 . . . . 0.0 110.335 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.655 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 0.0 OUTLIER -63.38 142.95 58.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.886 -1.134 . . . . 0.0 109.123 179.345 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.543 ' NH1' ' O ' ' A' ' 129' ' ' ASN . 10.4 mpt_? -69.29 144.72 53.5 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.519 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -74.43 1.02 12.75 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.408 -0.807 . . . . 0.0 109.506 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.887 " O5'" ' H6 ' ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.125 0 O4'-C1'-C2' 108.841 2.492 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.033 0 O4'-C4'-C3' 107.929 2.329 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.887 0 O4'-C4'-C3' 107.517 1.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.353 0 O4'-C4'-C3' 107.91 2.31 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O5'-C5'-C4' 113.088 2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.08 0 O5'-C5'-C4' 113.175 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.728 0 O4'-C4'-C3' 107.393 1.793 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.608 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.154 0 O4'-C4'-C3' 107.729 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.006 0 O5'-C5'-C4' 113.122 2.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.874 2.274 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.722 0 O5'-C5'-C4' 112.955 1.968 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.82 0 O5'-C5'-C4' 113.2 2.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C4'-C3' 107.725 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 0 O4'-C4'-C3' 107.371 1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.05 0 O4'-C4'-C3' 107.975 2.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.442 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.264 0 O4'-C1'-N19 106.657 -1.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.442 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O4'-C4'-C3' 108.123 2.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.095 0 O5'-C5'-C4' 112.506 1.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.804 0 O5'-C5'-C4' 113.717 2.512 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.969 0 O4'-C4'-C3' 107.66 2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.553 ' P ' HH12 ' A' ' 130' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.822 0 O5'-C5'-C4' 113.141 2.1 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.034 0 O5'-C5'-C4' 113.228 2.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.104 0 O5'-C5'-C4' 113.45 2.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.184 0 O4'-C1'-C2' 108.663 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.322 0 O4'-C4'-C3' 108.051 2.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.21 0 O4'-C4'-C3' 107.826 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.306 0 O4'-C4'-C3' 107.802 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.891 0 O4'-C4'-C3' 107.853 2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.021 0 O4'-C4'-C3' 107.74 2.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O4'-C4'-C3' 107.515 1.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 35.2 p90 -67.78 152.23 45.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.192 -1.181 . . . . 0.0 109.559 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.682 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -98.65 137.22 37.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.332 -0.855 . . . . 0.0 109.568 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -55.77 -37.18 68.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.441 -0.787 . . . . 0.0 109.871 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.27 -43.17 98.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.788 -1.195 . . . . 0.0 108.761 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.682 ' H ' ' HG ' ' A' ' 5' ' ' SER . 97.3 mt-10 -55.85 -40.5 72.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.333 -0.854 . . . . 0.0 108.846 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 33.3 mm-40 -77.39 -37.99 50.8 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.338 -0.851 . . . . 0.0 109.59 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.01 -49.76 65.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.975 -1.078 . . . . 0.0 109.649 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -62.19 -42.14 99.0 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.172 -0.955 . . . . 0.0 109.336 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mm100 -65.27 -49.76 68.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.58 -0.7 . . . . 0.0 110.805 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.1 m -71.74 -35.99 57.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 120.692 -1.255 . . . . 0.0 108.641 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.494 ' O ' ' OE1' ' A' ' 18' ' ' GLU . 6.9 tpt180 -54.56 -40.81 69.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.614 -1.304 . . . . 0.0 107.532 178.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -58.49 -31.4 67.81 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 mt -72.63 -37.34 68.06 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.433 -0.792 . . . . 0.0 111.469 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.509 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.5 m-85 -77.49 -33.13 54.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.364 -1.46 . . . . 0.0 110.009 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.503 ' O ' ' C ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -69.48 -27.86 65.58 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.088 -1.007 . . . . 0.0 111.282 -177.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.503 ' C ' ' O ' ' A' ' 18' ' ' GLU . 19.3 mt -35.74 -38.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.672 -0.642 . . . . 0.0 110.161 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.515 ' ND2' ' N ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -173.56 168.24 4.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.071 -1.018 . . . . 0.0 110.153 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -90.86 74.43 6.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.656 -0.653 . . . . 0.0 110.044 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -108.82 134.36 20.36 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.7 -59.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 122.079 1.853 . . . . 0.0 112.305 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -58.66 -34.18 70.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.616 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.645 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -57.09 -42.12 80.16 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.016 -1.052 . . . . 0.0 109.384 -179.613 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -61.4 -54.27 45.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.903 -1.123 . . . . 0.0 108.707 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -52.97 -37.24 61.02 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -62.47 -62.57 1.66 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.48 -0.763 . . . . 0.0 109.854 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.433 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 82.0 mt -54.8 -46.34 74.47 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 121.528 0.68 . . . . 0.0 109.72 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.509 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 98.1 m-20 -61.4 -49.65 76.01 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.003 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -66.54 -43.62 84.64 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.179 -0.95 . . . . 0.0 110.197 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.33 -52.12 64.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.967 . . . . 0.0 110.416 -178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.433 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 43.9 m-85 -62.48 -32.63 73.56 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.771 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 t -67.51 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 111.311 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.597 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -63.6 -27.32 69.16 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 111.232 -178.422 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.0 mmm -64.13 -39.55 94.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.934 -1.104 . . . . 0.0 111.057 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.09 -36.39 81.56 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.939 -1.101 . . . . 0.0 110.524 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -59.4 -50.09 75.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.211 -0.931 . . . . 0.0 111.065 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.416 HH11 ' HB3' ' A' ' 108' ' ' PRO . 28.5 mtp180 -64.19 -19.78 65.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.807 -178.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.91 3.47 55.91 Favored Glycine 0 N--CA 1.482 1.718 0 N-CA-C 108.187 -1.965 . . . . 0.0 108.187 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.1 p -117.42 83.99 17.58 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.587 -0.949 . . . . 0.0 108.943 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.66 150.36 2.3 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 123.441 2.76 . . . . 0.0 111.755 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.487 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 55.7 mt -84.87 98.19 5.96 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 120.865 -1.147 . . . . 0.0 109.153 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 25.0 m120 -79.65 -12.95 59.8 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.466 ' CG ' ' O ' ' A' ' 45' ' ' ARG . 0.5 OUTLIER -159.4 122.93 3.72 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 3.6 mt -71.46 147.1 92.41 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 120.728 -1.232 . . . . 0.0 109.349 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.82 138.14 40.15 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 121.279 1.319 . . . . 0.0 108.967 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.544 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.6 mt -105.64 146.08 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 120.9 -1.125 . . . . 0.0 110.17 -178.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 77.9 mtp -143.26 122.37 12.9 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.428 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 69.47 39.8 1.54 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 72.6 mttt 58.15 24.49 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.478 0.656 . . . . 0.0 109.654 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 85.8 p -138.31 157.3 46.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.533 -0.729 . . . . 0.0 109.153 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -69.54 149.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.965 -1.084 . . . . 0.0 109.472 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.1 tp -82.12 124.24 29.68 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.378 -0.826 . . . . 0.0 109.741 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.41 92.94 0.07 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.592 -0.693 . . . . 0.0 110.065 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -54.34 -26.21 28.57 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 120.821 -1.174 . . . . 0.0 109.318 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -78.4 -62.6 1.63 Allowed 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.951 . . . . 0.0 111.584 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.68 -36.65 67.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.685 -1.259 . . . . 0.0 109.458 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.6 tp -61.07 -45.63 93.97 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.431 ' O ' ' C ' ' A' ' 61' ' ' ASN . 67.8 t80 -61.83 -68.13 0.35 Allowed 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.296 0.569 . . . . 0.0 109.506 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.431 ' C ' ' O ' ' A' ' 60' ' ' TYR . 57.3 t30 -42.57 -36.98 1.52 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.405 -0.809 . . . . 0.0 109.567 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.0 mt -70.42 -50.86 34.14 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.031 -1.043 . . . . 0.0 108.448 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.481 ' CG2' ' CE2' ' A' ' 102' ' ' TYR . 42.3 t -58.05 -42.59 83.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.097 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.425 HG13 ' CE2' ' A' ' 60' ' ' TYR . 11.2 mm -70.14 -34.82 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.572 -1.33 . . . . 0.0 108.151 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.412 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.33 -24.1 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.735 -0.603 . . . . 0.0 110.724 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.412 HH11 ' HB3' ' A' ' 65' ' ' ALA . 8.0 mpt_? -94.14 3.72 54.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.622 -1.298 . . . . 0.0 109.564 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 16.21 69.99 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.251 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.92 134.89 3.38 Favored Glycine 0 N--CA 1.501 2.995 0 O-C-N 120.502 -1.587 . . . . 0.0 111.424 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.412 HD12 ' CH2' ' A' ' 78' ' ' TRP . 16.1 tp -52.74 -40.18 62.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.644 -0.916 . . . . 0.0 110.863 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.6 t -57.05 -42.98 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.893 -1.129 . . . . 0.0 109.318 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -57.56 -40.39 78.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.918 -1.113 . . . . 0.0 109.538 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 78.8 t -64.69 -43.19 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.376 -0.828 . . . . 0.0 110.271 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.426 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 61.1 mt -66.33 -55.4 18.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 O-C-N 120.878 -1.139 . . . . 0.0 110.273 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -57.63 -42.39 83.3 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.159 -0.963 . . . . 0.0 110.266 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -93.58 -9.4 38.27 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.196 -0.94 . . . . 0.0 110.643 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 27.2 mtmm 58.56 60.17 2.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.409 -0.807 . . . . 0.0 109.849 -178.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.1 mt -90.88 14.94 12.34 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.525 ' O ' ' N ' ' A' ' 82' ' ' ILE . 99.0 m95 -61.27 -40.86 95.68 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.5 mt-30 -47.22 -39.9 15.1 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.748 -1.22 . . . . 0.0 108.673 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -68.54 -41.68 79.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.2 mt -69.5 -52.85 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.525 ' N ' ' O ' ' A' ' 78' ' ' TRP . 50.5 mt -53.98 -55.34 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.607 -0.683 . . . . 0.0 109.448 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 86' ' ' HIS . 68.5 mttt -68.4 -42.27 79.27 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.336 -0.853 . . . . 0.0 109.869 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.16 -31.36 26.29 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.3 mt -91.15 -7.45 51.46 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.463 -1.022 . . . . 0.0 109.037 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 83' ' ' LYS . 71.3 m-70 62.8 42.32 8.06 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.837 -0.539 . . . . 0.0 110.124 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.7 mt -71.95 137.61 82.28 Favored Pre-proline 0 N--CA 1.488 1.453 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.609 ' C ' ' H ' ' A' ' 90' ' ' SER . 31.6 Cg_endo -66.9 141.57 59.23 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.892 1.728 . . . . 0.0 112.264 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 32.5 m -55.82 1.26 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.201 -0.937 . . . . 0.0 109.995 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.609 ' H ' ' C ' ' A' ' 88' ' ' PRO . 85.4 p -65.89 -25.35 67.13 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.099 -1.001 . . . . 0.0 109.805 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.455 HD13 HG22 ' A' ' 91' ' ' ILE . 74.1 mt -100.47 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.064 -1.023 . . . . 0.0 109.205 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.4 p -76.98 -23.32 52.3 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.178 -0.951 . . . . 0.0 109.164 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.1 m -100.25 39.27 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.448 -0.783 . . . . 0.0 109.067 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.55 -63.75 1.05 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.87 . . . . 0.0 109.294 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -46.23 -51.53 14.19 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.21 -0.932 . . . . 0.0 109.612 -179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -59.01 -43.32 91.53 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.774 -1.204 . . . . 0.0 108.895 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 63.6 m -60.92 -41.24 95.77 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.992 -1.067 . . . . 0.0 108.531 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mt -70.19 -44.11 69.37 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.498 -0.751 . . . . 0.0 109.841 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.524 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.3 ttm-85 -67.0 -53.37 32.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.292 -0.88 . . . . 0.0 110.925 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 m -55.0 -50.06 69.95 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.029 -1.044 . . . . 0.0 109.335 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -64.2 -43.87 93.72 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.145 -0.972 . . . . 0.0 111.624 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.481 ' CE2' ' CG2' ' A' ' 63' ' ' VAL . 3.3 t80 -58.35 -41.42 84.64 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.422 -1.424 . . . . 0.0 109.183 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.442 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 81.5 mtp -50.91 -56.48 12.1 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.584 -0.697 . . . . 0.0 111.431 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.0 mttt -73.58 -55.92 5.69 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.933 -1.104 . . . . 0.0 113.15 -176.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -84.24 -46.4 11.87 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 115.4 1.629 . . . . 0.0 115.4 -174.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.8 mp -97.6 -4.87 36.75 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.212 -1.555 . . . . 0.0 113.177 -176.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 39.2 t80 -62.81 -36.65 27.3 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 120.074 -1.641 . . . . 0.0 109.466 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.6 Cg_exo -66.17 -52.74 0.79 Allowed 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 122.15 1.9 . . . . 0.0 111.678 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.29 -48.46 80.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.292 -0.88 . . . . 0.0 109.504 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.49 -47.77 69.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.118 -0.989 . . . . 0.0 110.368 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.6 t -73.99 -46.36 44.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.984 -1.073 . . . . 0.0 110.719 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.597 ' OE1' ' CZ ' ' A' ' 35' ' ' PHE . 35.2 tt0 -66.88 -51.89 50.0 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 120.904 -1.122 . . . . 0.0 111.304 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -74.57 -32.39 62.38 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.119 -0.988 . . . . 0.0 111.874 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -117.25 -29.69 5.82 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.895 -1.128 . . . . 0.0 111.616 -177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 111' ' ' CYS . 19.0 t-20 54.83 44.78 27.88 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.683 -1.261 . . . . 0.0 110.481 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.36 -28.33 67.86 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.992 -1.068 . . . . 0.0 110.903 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.651 ' HG ' ' H ' ' A' ' 118' ' ' THR . 4.5 t -153.61 -168.17 2.91 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.273 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.651 ' H ' ' HG ' ' A' ' 117' ' ' SER . 71.1 p -122.8 152.5 62.51 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.53 -178.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.637 ' N ' ' HH ' ' A' ' 107' ' ' TYR . 9.5 Cg_endo -55.02 -36.76 93.45 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 C-N-CA 122.042 1.828 . . . . 0.0 112.08 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.33 83.24 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.943 -1.098 . . . . 0.0 109.243 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.489 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.7 mt-10 -65.93 -44.49 84.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 177.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.426 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 33.0 tp -63.56 -51.79 63.85 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.727 -0.608 . . . . 0.0 109.445 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -58.01 -50.13 74.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.241 -0.912 . . . . 0.0 109.658 178.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.24 -41.4 96.83 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.41 -0.806 . . . . 0.0 110.209 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.57 74.66 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.442 ' CD1' ' SD ' ' A' ' 103' ' ' MET . 5.5 mt -63.46 -49.78 81.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.97 -36.96 82.99 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.23 -32.98 78.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.64 ' C ' HD21 ' A' ' 129' ' ' ASN . 0.2 OUTLIER -92.59 -29.47 16.13 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.016 -1.285 . . . . 0.0 110.366 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.697 HH22 ' P ' ' C' ' 421' ' ' ' DT' . 0.0 OUTLIER -61.13 141.65 57.29 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.088 -1.007 . . . . 0.0 109.855 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.463 ' NH1' ' O ' ' A' ' 129' ' ' ASN . 11.6 mpt_? -74.43 156.62 36.8 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.429 -0.794 . . . . 0.0 109.353 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.03 111.33 23.03 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.257 -0.902 . . . . 0.0 109.191 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.917 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.863 " O5'" ' H6 ' ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C1'-C2' 108.752 2.411 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.1 0 O4'-C4'-C3' 107.942 2.342 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O5'-C5'-C4' 112.689 1.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.427 0 O5'-C5'-C4' 113.505 2.361 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.133 0 O5'-C5'-C4' 113.181 2.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.177 0 O5'-C5'-C4' 112.995 1.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.057 0 O5'-C5'-C4' 113.038 2.027 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.544 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.267 0 O4'-C1'-C2' 108.561 2.237 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . 0.416 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.217 0 O5'-C5'-C4' 113.332 2.237 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.164 0 O4'-C4'-C3' 107.854 2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.041 0 O5'-C5'-C4' 113.255 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . 0.501 ' C6 ' ' N6 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.272 0 O5'-C5'-C4' 113.418 2.298 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.998 0 O4'-C4'-C3' 107.813 2.213 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C4'-C3' 107.462 1.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.314 0 O4'-C4'-C3' 107.975 2.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.828 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.949 0 O4'-C1'-C2' 109.047 2.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.382 0 O4'-C1'-C2' 108.73 2.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.501 ' N6 ' ' C6 ' ' B' ' 412' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.303 0 O5'-C5'-C4' 112.905 1.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.41 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O5'-C5'-C4' 113.771 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.555 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.528 2.172 0 O4'-C4'-C3' 107.818 2.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.697 ' P ' HH22 ' A' ' 130' ' ' ARG . . . . . . . . 0 C5'--C4' 1.528 2.097 0 O5'-C5'-C4' 113.307 2.219 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.983 0 O5'-C5'-C4' 113.578 2.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . 0.416 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.911 0 O5'-C5'-C4' 113.486 2.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.91 0 O4'-C1'-C2' 108.774 2.431 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.238 0 O5'-C5'-C4' 113.508 2.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.091 0 O4'-C4'-C3' 107.571 1.971 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.512 0 O4'-C4'-C3' 107.776 2.176 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.835 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O4'-C4'-C3' 107.99 2.39 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C4'-C3' 107.615 2.015 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -111.4 83.24 1.74 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -1.104 . . . . 0.0 109.098 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.517 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 2.1 p -113.56 139.66 48.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 109.12 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -55.24 -34.32 63.91 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 109.603 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.55 -45.45 90.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.056 -1.027 . . . . 0.0 109.417 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.517 ' H ' ' HG ' ' A' ' 5' ' ' SER . 96.0 mt-10 -57.69 -47.83 81.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.224 -0.923 . . . . 0.0 109.975 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.48 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 35.4 mt-30 -67.22 -36.38 81.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.194 -0.941 . . . . 0.0 109.261 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.83 -47.66 51.36 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.334 -0.854 . . . . 0.0 109.052 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -62.29 -41.56 98.6 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.156 -0.965 . . . . 0.0 109.6 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -65.78 -51.14 61.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.948 . . . . 0.0 110.47 -179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -70.92 -37.05 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 120.989 -1.07 . . . . 0.0 109.845 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.592 HH11 ' CG ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -61.39 -38.37 86.82 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 119.926 -1.734 . . . . 0.0 108.03 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -30.23 66.24 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.37 -39.55 77.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.459 -0.775 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.461 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -76.15 -35.44 59.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.375 -1.453 . . . . 0.0 110.158 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.3 mt-10 -62.21 -27.74 69.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.036 -1.04 . . . . 0.0 110.019 -177.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 29.9 mt -39.72 -41.01 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 121.7 -0.625 . . . . 0.0 110.346 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.8 m120 -170.32 157.87 6.38 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.07 -1.019 . . . . 0.0 109.341 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 58.4 p30 -94.15 63.25 3.11 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.3 144.28 27.8 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.165 -0.959 . . . . 0.0 108.942 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.25 -60.57 0.06 OUTLIER 'Trans proline' 0 C--N 1.312 -1.356 0 C-N-CA 122.164 1.909 . . . . 0.0 111.771 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -61.33 -36.1 79.23 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.307 -0.87 . . . . 0.0 109.493 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.559 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.3 ttt-85 -57.99 -45.98 85.92 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.978 -1.076 . . . . 0.0 109.192 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -61.46 -56.82 15.93 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.223 -0.923 . . . . 0.0 109.458 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -51.75 -35.25 42.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.498 -0.751 . . . . 0.0 109.585 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -63.17 -62.3 1.79 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 110.655 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.411 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 62.8 mt -53.23 -46.82 69.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.882 . . . . 0.0 109.322 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.461 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.1 m-20 -61.27 -46.91 88.4 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.086 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.403 -0.81 . . . . 0.0 110.067 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.405 HD12 ' CD2' ' A' ' 109' ' ' TYR . 63.5 tp -59.04 -50.06 75.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.028 -1.045 . . . . 0.0 110.733 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -63.06 -35.51 80.5 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.357 -1.337 . . . . 0.0 107.796 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 t -68.25 -52.52 32.99 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.522 -0.736 . . . . 0.0 109.702 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.61 -42.52 88.38 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.506 -0.746 . . . . 0.0 110.378 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.516 ' CE ' ' O ' ' A' ' 41' ' ' THR . 61.6 mmm -60.13 -38.59 83.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.478 -0.764 . . . . 0.0 111.027 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -57.7 -37.06 72.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.658 -1.276 . . . . 0.0 108.833 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.421 ' HA ' ' HZ2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -67.36 -47.88 69.12 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.338 -0.851 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG3' HH11 ' A' ' 39' ' ' ARG . 2.6 mmm-85 -63.63 -22.59 66.98 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.21 -0.931 . . . . 0.0 110.798 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.24 2.81 61.94 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.516 ' O ' ' CE ' ' A' ' 36' ' ' MET . 60.0 p -116.4 83.64 13.49 Favored Pre-proline 0 N--CA 1.491 1.6 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -85.32 143.81 8.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.877 2.385 . . . . 0.0 111.196 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.419 HG21 HD11 ' A' ' 43' ' ' ILE . 13.7 mt -82.87 103.45 10.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 O-C-N 120.841 -1.162 . . . . 0.0 109.818 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.48 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 90.7 m-20 -67.37 -55.82 12.2 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.572 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.1 OUTLIER -127.31 133.64 50.09 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.177 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -70.91 146.35 92.97 Favored Pre-proline 0 C--N 1.3 -1.571 0 O-C-N 121.074 -1.016 . . . . 0.0 109.59 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -70.27 132.17 21.97 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.536 1.491 . . . . 0.0 108.967 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.563 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 9.0 mt -99.55 141.4 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 120.771 -1.206 . . . . 0.0 109.917 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 82.3 mtp -140.78 121.19 14.03 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 72.05 39.76 0.78 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.6 mttm 59.41 20.57 8.9 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.257 0.551 . . . . 0.0 110.161 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -139.74 159.35 42.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.093 -1.005 . . . . 0.0 109.395 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.15 146.35 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.985 -1.072 . . . . 0.0 109.414 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.7 tp -78.29 124.8 28.5 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.197 -0.94 . . . . 0.0 108.936 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.17 98.41 0.14 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.692 -0.63 . . . . 0.0 110.449 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.8 mt -56.16 -28.0 56.41 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.97 -1.081 . . . . 0.0 108.566 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -77.68 -60.77 2.23 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.178 -0.951 . . . . 0.0 111.825 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.7 -37.87 74.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.778 -1.201 . . . . 0.0 109.257 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 52.1 tp -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CZ ' HD13 ' A' ' 64' ' ' ILE . 48.8 t80 -62.13 -66.91 0.47 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.674 -0.641 . . . . 0.0 110.072 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 60' ' ' TYR . 58.1 t30 -40.02 -40.86 1.12 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.537 -0.727 . . . . 0.0 111.21 -178.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 mt -73.97 -46.67 42.48 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.031 -1.467 . . . . 0.0 108.023 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.402 HG23 ' CE2' ' A' ' 102' ' ' TYR . 37.3 t -53.97 -44.15 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.001 -1.062 . . . . 0.0 109.833 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.409 HD13 ' CZ ' ' A' ' 60' ' ' TYR . 7.3 mm -68.22 -36.47 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.685 -1.259 . . . . 0.0 107.794 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.82 -15.64 22.28 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.669 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.675 HH21 ' CB ' ' A' ' 80' ' ' GLU . 18.1 mmt-85 -98.27 1.71 47.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.346 -1.471 . . . . 0.0 108.554 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.31 13.01 74.77 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.42 -0.895 . . . . 0.0 111.572 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.87 137.29 3.73 Favored Glycine 0 N--CA 1.504 3.193 0 O-C-N 120.532 -1.569 . . . . 0.0 111.901 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 tp -51.85 -41.72 62.04 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.756 -0.85 . . . . 0.0 110.29 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.78 -43.72 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.009 -1.057 . . . . 0.0 109.413 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -57.07 -40.48 76.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.067 -1.021 . . . . 0.0 109.238 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 50.8 t -61.83 -43.41 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.45 -0.781 . . . . 0.0 109.916 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -58.55 6.34 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 O-C-N 120.711 -1.243 . . . . 0.0 110.394 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -57.74 -41.05 81.08 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.147 -0.971 . . . . 0.0 110.667 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -93.46 -9.81 37.2 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 19.2 mtmt 59.07 59.36 2.79 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.289 -0.882 . . . . 0.0 109.643 -178.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.2 mt -93.95 15.58 16.49 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.89 -1.131 . . . . 0.0 108.592 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.464 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.9 m95 -63.02 -41.68 99.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.358 -0.838 . . . . 0.0 108.924 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.0 mt-30 -48.86 -39.11 24.45 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.519 -1.363 . . . . 0.0 108.442 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.675 ' CB ' HH21 ' A' ' 66' ' ' ARG . 73.7 mm-40 -66.32 -38.65 88.19 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.1 mt -75.26 -52.2 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 0.0 109.09 178.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.464 ' N ' ' O ' ' A' ' 78' ' ' TRP . 59.0 mt -51.25 -53.77 13.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.323 -0.861 . . . . 0.0 109.03 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -69.75 -38.71 76.9 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.27 -0.894 . . . . 0.0 109.334 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.43 -34.36 48.69 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 88.7 mt -86.68 -8.71 57.19 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.445 -1.033 . . . . 0.0 108.587 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 64.29 40.36 6.67 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.758 -0.589 . . . . 0.0 109.901 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -74.61 143.67 79.3 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 108.996 178.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.509 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.4 Cg_endo -70.2 143.3 48.3 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.982 1.788 . . . . 0.0 111.597 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p -60.23 1.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.892 . . . . 0.0 110.162 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.509 ' H ' ' C ' ' A' ' 88' ' ' PRO . 91.4 p -66.43 -22.2 66.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.162 -0.962 . . . . 0.0 110.062 -178.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.4 mt -100.11 106.18 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.927 -1.108 . . . . 0.0 109.346 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.7 p -78.56 -25.33 45.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -0.949 . . . . 0.0 108.714 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -93.88 32.36 1.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' O ' ' C ' ' A' ' 95' ' ' ALA . . . -63.77 -65.5 0.67 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.32 -0.863 . . . . 0.0 109.096 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' ALA . . . -47.33 -52.14 17.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.99 -1.069 . . . . 0.0 108.99 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.479 ' O ' ' OG1' ' A' ' 100' ' ' THR . 8.4 tp -58.03 -44.76 87.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.097 -1.002 . . . . 0.0 109.191 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.3 m -61.78 -39.67 92.5 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.089 -1.007 . . . . 0.0 108.758 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.2 mt -67.44 -45.16 76.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.511 -0.743 . . . . 0.0 109.947 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -68.93 -49.24 59.81 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.139 -0.976 . . . . 0.0 111.219 -179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -55.01 -54.42 43.2 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 120.913 -1.117 . . . . 0.0 109.565 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -63.42 -42.38 98.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.097 -1.002 . . . . 0.0 111.777 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.402 ' CE2' HG23 ' A' ' 63' ' ' VAL . 3.6 t80 -57.13 -42.73 81.47 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.162 -1.586 . . . . 0.0 109.142 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.422 ' SD ' ' CD1' ' A' ' 126' ' ' ILE . 84.7 mtp -54.41 -56.21 20.94 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.623 -0.673 . . . . 0.0 112.337 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -71.4 -48.89 46.97 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.28 -1.512 . . . . 0.0 112.392 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -86.29 -52.35 5.69 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -174.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.552 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.0 mp -98.0 12.15 35.2 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.287 -1.508 . . . . 0.0 113.74 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.569 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 55.2 t80 -66.89 -37.15 13.15 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 119.93 -1.731 . . . . 0.0 111.638 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.7 Cg_endo -82.47 -38.75 0.17 Allowed 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.705 1.604 . . . . 0.0 112.532 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.405 ' CD2' HD12 ' A' ' 32' ' ' LEU . 7.7 t80 -58.7 -41.39 86.19 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 178.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -72.02 -49.34 37.69 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.569 -0.707 . . . . 0.0 109.926 179.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.8 OUTLIER -73.82 -45.48 51.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.324 -0.86 . . . . 0.0 110.891 -178.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.43 -47.77 72.15 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.057 -1.027 . . . . 0.0 110.905 -178.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 22.0 mmtp -77.02 -27.33 54.54 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 120.978 -1.076 . . . . 0.0 111.333 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -125.3 -29.27 3.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.9 -1.125 . . . . 0.0 111.536 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 111' ' ' CYS . 61.6 t30 59.45 45.13 14.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.59 -1.319 . . . . 0.0 109.987 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 79.5 mt -67.82 -33.63 75.16 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.301 -0.875 . . . . 0.0 111.211 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 118' ' ' THR . 28.8 t -154.28 -166.98 2.49 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.627 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.547 ' N ' ' OG ' ' A' ' 117' ' ' SER . 77.9 p -128.45 163.36 45.08 Favored Pre-proline 0 N--CA 1.498 1.934 0 O-C-N 121.795 -0.566 . . . . 0.0 109.86 -178.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.413 ' CD ' ' OH ' ' A' ' 107' ' ' TYR . 35.9 Cg_exo -59.7 -40.31 65.71 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 121.763 1.642 . . . . 0.0 112.404 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.08 -37.94 89.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.825 -1.172 . . . . 0.0 109.665 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.479 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -67.0 -44.92 79.13 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.1 tp -66.51 -53.19 37.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.597 -0.69 . . . . 0.0 110.275 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -56.18 -46.55 79.34 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 108.982 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.79 -39.31 88.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.468 -0.77 . . . . 0.0 109.77 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.51 76.48 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.233 -0.917 . . . . 0.0 108.664 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.422 ' CD1' ' SD ' ' A' ' 103' ' ' MET . 16.9 mt -65.01 -49.48 79.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.89 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -62.08 -37.94 86.93 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.44 -32.72 85.15 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.617 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -93.94 -33.51 13.44 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.805 -1.409 . . . . 0.0 110.592 -179.017 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.617 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 54.6 mtp180 -63.04 143.78 57.47 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.748 -1.22 . . . . 0.0 109.616 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.482 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -60.09 154.49 19.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.833 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -87.27 107.11 18.35 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.093 -1.005 . . . . 0.0 109.793 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.424 -1.471 . . . . 0.0 109.424 179.754 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.974 0 O4'-C1'-C2' 108.202 1.911 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.561 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C1'-C2' 108.503 2.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.869 0 O4'-C4'-C3' 107.345 1.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.181 0 O4'-C4'-C3' 107.77 2.17 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.146 0 O5'-C5'-C4' 113.152 2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.349 0 O5'-C5'-C4' 113.311 2.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.232 0 O5'-C5'-C4' 112.924 1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.563 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.606 1.339 0 C4'-C3'-C2' 105.296 2.096 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.042 0 O5'-C5'-C4' 113.254 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O5'-C5'-C4' 113.367 2.262 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.955 0 O5'-C5'-C4' 113.032 2.023 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . 0.403 ' C6 ' ' N6 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.977 0 O5'-C5'-C4' 113.143 2.102 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.732 0 O4'-C4'-C3' 107.766 2.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.827 0 O4'-C4'-C3' 107.277 1.677 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.89 0 O4'-C4'-C3' 107.941 2.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.438 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.244 0 O4'-C1'-C2' 107.806 1.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.438 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.444 0 O4'-C1'-C2' 108.748 2.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.467 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.255 0 O5'-C5'-C4' 112.487 1.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.467 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.59 0 O5'-C5'-C4' 113.62 2.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.464 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C4'-C3' 107.681 2.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.587 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O5'-C5'-C4' 113.428 2.306 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.587 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.993 0 O5'-C5'-C4' 113.452 2.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.767 0 O5'-C5'-C4' 113.389 2.278 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.305 0 O5'-C5'-C4' 113.524 2.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.059 0 O4'-C4'-C3' 108.023 2.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C4'-C3' 107.71 2.11 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.773 0 O4'-C4'-C3' 107.802 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.903 0 O5'-C5'-C4' 113.065 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.141 0 O5'-C5'-C4' 113.041 2.029 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.462 1.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.376 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 28.3 p90 -67.05 152.02 46.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.218 -1.166 . . . . 0.0 109.624 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.489 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -95.69 141.05 29.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.323 -0.86 . . . . 0.0 109.543 -179.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -54.96 -38.82 68.23 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.452 -0.78 . . . . 0.0 110.755 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -62.5 -42.0 99.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.834 -1.166 . . . . 0.0 109.179 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.489 ' H ' ' HG ' ' A' ' 5' ' ' SER . 97.1 mt-10 -56.07 -40.34 73.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.298 -0.876 . . . . 0.0 109.24 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.601 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 45.9 mm-40 -72.65 -37.27 68.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.185 -0.947 . . . . 0.0 109.879 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CE1' ' NE ' ' A' ' 14' ' ' ARG . 84.6 t80 -58.75 -52.54 65.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.213 -0.93 . . . . 0.0 109.733 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -61.5 -47.11 87.11 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.272 -0.893 . . . . 0.0 109.889 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.85 -50.42 68.93 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.418 -0.801 . . . . 0.0 110.896 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -69.48 -34.61 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 120.61 -1.306 . . . . 0.0 108.595 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.64 ' NE ' ' CE1' ' A' ' 10' ' ' PHE . 13.1 mmt180 -62.68 -39.95 95.56 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.512 -1.367 . . . . 0.0 107.787 178.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.71 -26.02 55.83 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.7 mt -78.66 -37.59 41.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.536 -0.727 . . . . 0.0 111.835 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.491 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.4 m-85 -79.35 -31.08 42.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.389 -1.445 . . . . 0.0 110.468 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -63.61 -29.81 71.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.882 -1.136 . . . . 0.0 109.639 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.403 ' CG2' HH12 ' A' ' 25' ' ' ARG . 56.9 mt -43.07 -45.47 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 O-C-N 121.571 -0.705 . . . . 0.0 110.248 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.781 HD22 HH11 ' A' ' 25' ' ' ARG . 0.0 OUTLIER 179.98 125.46 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.238 -0.914 . . . . 0.0 108.618 178.029 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -82.21 78.1 8.93 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 111.416 -177.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -98.01 124.23 48.36 Favored Pre-proline 0 N--CA 1.489 1.487 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -36.39 -57.52 0.58 Allowed 'Trans proline' 0 C--N 1.313 -1.295 0 C-N-CA 122.208 1.938 . . . . 0.0 113.22 -178.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -62.78 -42.07 99.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.047 -1.033 . . . . 0.0 110.76 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.781 HH11 HD22 ' A' ' 20' ' ' ASN . 60.7 ttt180 -60.67 -45.13 95.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.809 -1.182 . . . . 0.0 111.678 -178.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -59.89 -51.18 70.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.37 -1.456 . . . . 0.0 108.701 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -54.68 -36.46 64.67 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -59.11 -66.04 0.57 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.277 -0.889 . . . . 0.0 110.221 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.8 mt -55.95 -43.0 77.04 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.495 0.664 . . . . 0.0 109.535 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.9 m-20 -60.36 -50.25 74.34 Favored 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.305 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.426 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 56.8 t0 -66.98 -43.56 82.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.227 -0.921 . . . . 0.0 109.838 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.456 ' O ' ' CG ' ' A' ' 36' ' ' MET . 46.9 tp -54.69 -54.07 46.62 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.336 -0.853 . . . . 0.0 110.198 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.34 -33.64 75.97 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.594 -1.316 . . . . 0.0 108.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.6 t -69.81 -63.19 1.12 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.618 -0.676 . . . . 0.0 111.271 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.467 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -62.01 -32.09 72.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.111 -0.993 . . . . 0.0 110.723 -178.511 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.456 ' CG ' ' O ' ' A' ' 32' ' ' LEU . 62.2 mmm -59.43 -34.92 73.1 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.985 -1.072 . . . . 0.0 109.866 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.59 -40.15 93.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.242 -0.911 . . . . 0.0 110.321 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -58.43 -48.08 81.87 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.465 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.3 OUTLIER -63.71 -21.93 66.65 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.385 -0.822 . . . . 0.0 110.559 -178.35 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.62 7.43 60.26 Favored Glycine 0 N--CA 1.481 1.643 0 N-CA-C 107.837 -2.105 . . . . 0.0 107.837 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 p -117.89 85.2 22.33 Favored Pre-proline 0 N--CA 1.492 1.641 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -93.73 146.72 2.13 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 123.346 2.697 . . . . 0.0 112.154 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.422 HG23 HD11 ' A' ' 43' ' ' ILE . 80.2 mt -79.22 95.59 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 109.535 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.601 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 19.6 m120 -59.37 -28.58 67.0 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -160.64 138.22 9.44 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.434 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -71.69 145.2 89.43 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 120.976 -1.078 . . . . 0.0 108.544 -179.365 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -66.77 131.34 25.51 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.235 1.29 . . . . 0.0 109.215 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.541 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 8.9 mt -97.39 143.31 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 120.903 -1.123 . . . . 0.0 110.126 -178.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 75.1 mtp -138.98 121.92 16.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 67.78 40.56 2.4 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.1 mttm 57.17 24.24 9.54 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.47 0.652 . . . . 0.0 109.459 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.2 m -135.43 153.42 51.79 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.38 -0.825 . . . . 0.0 109.144 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -70.44 146.64 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.055 -1.028 . . . . 0.0 109.328 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.4 tp -79.14 123.8 27.72 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.402 -0.811 . . . . 0.0 110.445 -178.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -65.49 88.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.3 mt -54.42 -24.1 18.56 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 120.995 -1.066 . . . . 0.0 109.552 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.502 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 41.7 t80 -82.29 -56.6 3.81 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 111.735 -178.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.54 -38.49 81.16 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.531 -1.356 . . . . 0.0 109.321 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.6 tp -57.46 -46.49 83.59 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.417 ' CZ ' HD13 ' A' ' 64' ' ' ILE . 46.3 t80 -56.98 -64.58 0.83 Allowed 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.614 ' N ' HD21 ' A' ' 61' ' ' ASN . 1.4 m120 -44.3 -40.16 5.06 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.389 -0.819 . . . . 0.0 111.128 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 66' ' ' ARG . 6.9 mt -72.07 -44.34 63.46 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 118.085 -1.446 . . . . 0.0 107.518 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.41 HG22 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -60.09 -44.49 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.417 HD13 ' CZ ' ' A' ' 60' ' ' TYR . 12.3 mm -67.91 -36.5 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.467 -1.396 . . . . 0.0 107.981 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.4 -20.84 21.39 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.174 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.59 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -93.41 1.5 56.85 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.596 -1.315 . . . . 0.0 109.304 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.89 15.29 75.56 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.014 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.73 2.97 Favored Glycine 0 N--CA 1.498 2.816 0 O-C-N 120.463 -1.61 . . . . 0.0 111.309 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.425 ' N ' ' OE2' ' A' ' 110' ' ' GLU . 19.6 tp -48.45 -38.13 19.05 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.71 -0.876 . . . . 0.0 110.785 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.408 HG22 ' HG ' ' A' ' 117' ' ' SER . 97.0 t -57.95 -41.74 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 120.846 -1.159 . . . . 0.0 110.476 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -58.78 -37.6 76.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.97 . . . . 0.0 109.914 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' LYS . 21.2 t -66.13 -42.5 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 110.643 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.408 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 48.3 mt -69.48 -57.92 7.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 120.828 -1.17 . . . . 0.0 110.548 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -58.01 -41.53 83.33 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.047 -1.033 . . . . 0.0 110.333 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -92.4 -7.98 46.15 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.261 -0.899 . . . . 0.0 110.428 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.7 mttp 58.12 55.69 5.03 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.309 -0.87 . . . . 0.0 110.592 -179.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.1 mt -90.61 12.45 18.86 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.699 -1.25 . . . . 0.0 107.835 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.403 ' CH2' HD11 ' A' ' 69' ' ' LEU . 98.3 m95 -62.31 -41.34 98.46 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mm100 -48.86 -37.71 20.33 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.737 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.59 ' CB ' HH21 ' A' ' 66' ' ' ARG . 93.3 mt-10 -69.62 -40.82 76.35 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -67.49 -53.51 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.6 mt -51.27 -57.65 2.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.299 -0.876 . . . . 0.0 109.266 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -66.83 -37.4 84.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.153 -0.967 . . . . 0.0 109.467 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.91 -37.59 58.21 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.71 -8.71 58.75 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.329 -1.101 . . . . 0.0 108.17 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 69.0 41.16 1.48 Allowed 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.236 0.541 . . . . 0.0 110.844 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -73.4 148.44 88.23 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.196 -0.94 . . . . 0.0 108.789 177.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.29 170.25 18.75 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.301 2.001 . . . . 0.0 112.282 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.5 t -79.55 -1.74 39.16 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.46 -0.775 . . . . 0.0 109.4 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 24.4 m -65.06 -33.97 77.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.504 -0.748 . . . . 0.0 110.652 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.441 HG22 HD12 ' A' ' 91' ' ' ILE . 86.0 mt -92.76 98.89 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 120.637 -1.289 . . . . 0.0 109.263 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.411 ' HG1' ' N ' ' A' ' 93' ' ' SER . 31.9 p -72.21 -30.49 64.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.077 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.411 ' N ' ' HG1' ' A' ' 92' ' ' THR . 9.4 m -97.5 45.19 1.03 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.496 -0.752 . . . . 0.0 109.43 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -59.55 3.34 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.113 -0.992 . . . . 0.0 108.868 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -46.18 -50.55 15.57 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.197 -0.939 . . . . 0.0 109.633 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.49 ' O ' ' OG1' ' A' ' 100' ' ' THR . 7.4 tp -58.19 -43.75 87.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.681 -1.262 . . . . 0.0 109.023 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.1 m -62.5 -40.76 97.77 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.055 -1.028 . . . . 0.0 108.822 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.3 mt -69.3 -42.87 74.87 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.562 -0.711 . . . . 0.0 110.252 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.735 ' NH1' HD22 ' A' ' 129' ' ' ASN . 46.4 ttp180 -69.24 -50.11 50.11 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.155 -0.966 . . . . 0.0 110.859 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -54.31 -54.58 38.36 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.026 -1.046 . . . . 0.0 109.419 -179.015 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -62.86 -41.19 99.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.16 -0.962 . . . . 0.0 111.468 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.45 ' CE1' ' OE1' ' A' ' 110' ' ' GLU . 2.5 t80 -58.16 -43.93 87.65 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 119.826 -1.796 . . . . 0.0 109.153 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp -51.96 -56.52 13.69 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.78 -0.575 . . . . 0.0 112.097 -178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.1 mttm -73.48 -51.08 18.38 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.517 -1.364 . . . . 0.0 112.553 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -85.49 -48.1 9.28 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.534 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.8 mp -97.5 -1.51 43.93 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.23 -1.544 . . . . 0.0 113.433 -176.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.656 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 66.2 t80 -64.15 -36.06 18.06 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 119.865 -1.772 . . . . 0.0 109.709 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 10.6 Cg_exo -66.81 -51.73 0.83 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 C-N-CA 121.801 1.667 . . . . 0.0 111.213 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.426 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 1.3 t80 -58.03 -50.29 73.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.233 -0.917 . . . . 0.0 109.271 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.45 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 85.9 tt0 -65.67 -43.94 87.76 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.296 -0.878 . . . . 0.0 110.843 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.3 -45.31 18.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.983 . . . . 0.0 110.422 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 108' ' ' PRO . 32.0 tt0 -67.65 -51.87 44.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.269 -0.894 . . . . 0.0 111.417 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -75.33 -29.62 60.03 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -0.97 . . . . 0.0 111.961 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -123.33 -28.92 3.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.972 -1.08 . . . . 0.0 111.852 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 30.0 t30 57.86 46.02 17.51 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.742 -1.224 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.86 -31.79 72.94 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.917 -1.114 . . . . 0.0 110.94 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.595 ' OG ' ' N ' ' A' ' 118' ' ' THR . 10.7 t -153.91 -167.01 2.53 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 119.001 -1.08 . . . . 0.0 111.192 -178.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.595 ' N ' ' OG ' ' A' ' 117' ' ' SER . 53.9 p -129.35 155.55 79.86 Favored Pre-proline 0 N--CA 1.5 2.054 0 O-C-N 121.474 -0.766 . . . . 0.0 110.583 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -49.91 -43.19 42.37 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 122.106 1.871 . . . . 0.0 112.42 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.14 88.58 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.789 -1.194 . . . . 0.0 109.371 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.492 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -65.97 -45.61 81.08 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.408 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 44.2 tp -66.54 -53.42 35.04 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 110.415 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -56.03 -45.04 79.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.775 -1.203 . . . . 0.0 109.128 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.27 96.67 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.461 -0.775 . . . . 0.0 110.333 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.31 -35.79 78.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 108.686 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.528 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 24.3 mt -64.77 -48.04 86.14 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 CA-C-O 121.536 0.684 . . . . 0.0 109.189 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -65.71 -36.93 85.02 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.045 -1.034 . . . . 0.0 108.967 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -63.4 -32.88 85.65 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.735 HD22 ' NH1' ' A' ' 99' ' ' ARG . 10.9 p-10 -94.02 -31.52 14.2 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.886 -1.361 . . . . 0.0 110.305 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.623 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 48.3 mtp180 -64.27 144.33 57.23 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.926 -1.109 . . . . 0.0 109.948 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -68.81 154.16 42.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.587 -0.696 . . . . 0.0 110.132 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -111.17 -152.66 0.5 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.901 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.898 0 O4'-C1'-C2' 108.525 2.205 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.521 0 O4'-C1'-C2' 108.417 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O4'-C4'-C3' 107.492 1.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.446 0 O5'-C5'-C4' 113.504 2.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.995 0 O5'-C5'-C4' 113.073 2.052 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.301 0 O5'-C5'-C4' 113.427 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.796 0 O5'-C5'-C4' 112.743 1.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.541 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.202 0 O4'-C4'-C3' 107.816 2.216 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.448 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.071 0 O5'-C5'-C4' 113.365 2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.018 0 O5'-C5'-C4' 113.277 2.198 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.874 0 O4'-C4'-C3' 107.905 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.845 0 O4'-C4'-C3' 108.0 2.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.88 0 O4'-C4'-C3' 107.733 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.207 0 O4'-C4'-C3' 107.883 2.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.793 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.871 0 O4'-C1'-C2' 108.973 2.612 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.556 0 C4'-C3'-C2' 105.645 2.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.086 0 O5'-C5'-C4' 112.913 1.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.322 0 C4'-C3'-C2' 105.694 2.494 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.426 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.774 0 O4'-C4'-C3' 108.082 2.482 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.421 ' C7 ' ' CD2' ' A' ' 96' ' ' LEU . . . . . . . . 0 P--O5' 1.609 1.626 0 O4'-C4'-C3' 107.763 2.163 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.007 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O5'-C5'-C4' 113.493 2.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.194 0 O5'-C5'-C4' 113.17 2.121 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O5'-C5'-C4' 113.5 2.357 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.148 0 O4'-C4'-C3' 107.694 2.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.24 0 O4'-C4'-C3' 107.828 2.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O5'-C5'-C4' 112.866 1.904 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.268 0 O4'-C4'-C3' 107.963 2.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.251 0 C1'-O4'-C4' 106.513 -2.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -115.56 80.47 1.44 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.411 -1.052 . . . . 0.0 109.276 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.84 143.81 43.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.331 -0.856 . . . . 0.0 109.635 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -55.94 -43.01 77.03 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.404 -0.81 . . . . 0.0 110.456 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.86 -40.13 94.65 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.628 -1.295 . . . . 0.0 110.2 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -59.68 -44.35 93.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.908 . . . . 0.0 111.373 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.438 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 33.5 mt-30 -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.83 -1.169 . . . . 0.0 110.262 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -55.54 -45.96 77.17 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.927 -1.108 . . . . 0.0 109.0 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -61.32 -41.34 96.84 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.821 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -66.32 -53.22 38.93 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.42 -0.8 . . . . 0.0 111.378 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.0 p -70.04 -35.49 64.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.084 -1.01 . . . . 0.0 110.688 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.531 ' HG2' HH11 ' A' ' 14' ' ' ARG . 1.1 tpt180 -62.18 -36.08 80.78 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 119.761 -1.837 . . . . 0.0 107.864 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -59.32 -32.58 70.2 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.2 mt -63.03 -39.12 93.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.345 -0.847 . . . . 0.0 110.648 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -80.46 -36.31 33.71 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.565 -1.335 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' A' ' 14' ' ' ARG . 76.5 mm-40 -65.23 -30.05 70.9 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.903 -1.123 . . . . 0.0 111.024 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.528 ' CG2' HH12 ' A' ' 25' ' ' ARG . 15.5 mt -38.13 -39.01 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 O-C-N 121.506 -0.746 . . . . 0.0 111.061 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -170.3 163.11 8.75 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.563 -1.336 . . . . 0.0 110.785 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -90.04 67.06 6.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.775 -0.578 . . . . 0.0 110.494 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.408 ' OD1' ' C ' ' A' ' 22' ' ' ASP . 51.7 t0 -111.98 99.46 45.78 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -49.62 -47.62 22.2 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.392 2.061 . . . . 0.0 112.845 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -37.65 80.14 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.035 -1.041 . . . . 0.0 108.951 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.528 HH12 ' CG2' ' A' ' 19' ' ' ILE . 66.0 ttt180 -60.34 -36.82 78.85 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.263 -0.898 . . . . 0.0 109.46 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.57 -50.46 73.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.189 -0.945 . . . . 0.0 109.177 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -53.41 -36.92 62.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 109.288 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.72 -61.72 2.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.51 -0.744 . . . . 0.0 110.926 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.407 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 65.1 mt -53.75 -48.21 69.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.449 -0.782 . . . . 0.0 110.204 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 78.6 m-20 -59.83 -51.73 68.49 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.39 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -65.92 -42.15 90.48 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.966 -1.084 . . . . 0.0 109.794 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 HD13 ' CD2' ' A' ' 109' ' ' TYR . 56.9 tp -57.64 -51.26 70.23 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.006 -1.059 . . . . 0.0 110.28 -178.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 -60.21 -34.59 73.86 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 118.441 -1.303 . . . . 0.0 108.01 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.6 m -67.48 -54.03 23.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.819 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CZ ' ' HG2' ' A' ' 112' ' ' GLU . 51.5 t80 -60.3 -39.48 87.1 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.178 -0.952 . . . . 0.0 109.958 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 76.4 mmm -58.72 -42.53 88.94 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.441 -0.787 . . . . 0.0 110.717 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.0 -35.53 81.49 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.892 -1.13 . . . . 0.0 109.726 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -59.0 -53.45 58.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.213 -0.929 . . . . 0.0 109.722 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.458 HH11 ' HB3' ' A' ' 108' ' ' PRO . 25.7 mtp180 -64.53 -18.04 64.47 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.503 -0.748 . . . . 0.0 111.626 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.57 5.09 60.37 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 107.817 -2.113 . . . . 0.0 107.817 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.9 p -115.62 83.74 11.58 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -87.12 146.44 7.63 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.898 2.398 . . . . 0.0 111.286 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.96 99.11 4.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 120.869 -1.144 . . . . 0.0 109.185 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.484 ' CB ' HH21 ' A' ' 45' ' ' ARG . 92.7 m-20 -64.99 -49.84 68.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.148 -0.97 . . . . 0.0 109.108 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.484 HH21 ' CB ' ' A' ' 44' ' ' ASN . 7.7 mtm180 -135.56 137.26 41.84 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.305 -0.872 . . . . 0.0 108.832 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.9 mt -71.9 141.96 84.98 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 120.951 -1.093 . . . . 0.0 109.368 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -71.16 108.16 2.28 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 121.483 1.455 . . . . 0.0 109.785 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.597 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 49.9 mt -76.92 143.22 13.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 110.298 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.404 ' N ' HG21 ' A' ' 48' ' ' ILE . 28.8 mmm -137.55 124.63 21.54 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.09 41.08 8.47 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.6 mttp 60.5 23.03 12.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.982 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.9 m -136.42 153.01 51.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.102 -0.999 . . . . 0.0 109.59 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.1 m -65.94 143.57 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 108.895 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.7 tp -75.12 122.45 23.61 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.076 -1.015 . . . . 0.0 109.554 -179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.04 97.16 0.08 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.423 -0.798 . . . . 0.0 109.022 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.7 mt -58.59 -27.98 65.14 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.3 -0.875 . . . . 0.0 109.138 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -80.27 -62.18 1.76 Allowed 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.863 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -55.51 -37.14 67.48 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.692 -1.255 . . . . 0.0 110.075 -178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.4 tp -63.11 -45.2 93.15 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.426 ' O ' ' C ' ' A' ' 61' ' ' ASN . 63.4 t80 -62.16 -66.57 0.52 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 60' ' ' TYR . 50.7 t-20 -42.54 -37.7 1.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.612 -0.68 . . . . 0.0 109.355 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.575 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 11.5 mt -70.36 -48.58 55.67 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.417 HG21 ' CE2' ' A' ' 102' ' ' TYR . 30.4 t -55.58 -42.17 67.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.256 -0.903 . . . . 0.0 110.051 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.45 HD13 HG22 ' A' ' 64' ' ' ILE . 10.9 mm -71.16 -33.59 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 120.795 -1.19 . . . . 0.0 107.888 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.53 -19.38 24.62 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.738 -0.785 . . . . 0.0 109.56 -179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.581 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.4 mmt-85 -96.79 -3.24 42.64 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.736 -1.228 . . . . 0.0 108.273 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 13.16 71.78 Favored Glycine 0 N--CA 1.491 2.341 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.059 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.07 131.45 2.45 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.297 -1.707 . . . . 0.0 111.714 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.6 tp -50.2 -41.21 49.19 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.589 -0.947 . . . . 0.0 109.998 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 80.0 t -61.49 -43.15 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.148 -0.97 . . . . 0.0 109.732 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -55.24 -38.8 68.97 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.971 -1.08 . . . . 0.0 108.862 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.637 ' O ' ' N ' ' A' ' 76' ' ' LYS . 47.0 t -64.22 -42.55 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.653 -0.654 . . . . 0.0 109.587 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.483 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 95.1 mt -65.38 -59.06 4.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.68 0 O-C-N 121.052 -1.03 . . . . 0.0 110.679 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -58.26 -40.58 82.21 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.104 -0.998 . . . . 0.0 110.4 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.7 mmtt -93.14 -12.22 30.94 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.211 -0.931 . . . . 0.0 110.855 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.637 ' N ' ' O ' ' A' ' 72' ' ' VAL . 15.1 mtmt 59.67 62.68 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.252 -0.905 . . . . 0.0 110.102 -178.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.1 14.33 24.21 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.094 -1.004 . . . . 0.0 108.627 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.413 ' O ' ' C ' ' A' ' 79' ' ' GLN . 81.8 m95 -63.44 -39.22 93.91 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.291 -0.881 . . . . 0.0 109.341 179.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.4 mm-40 -49.31 -38.29 27.12 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.651 -1.281 . . . . 0.0 108.28 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.581 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.9 mm-40 -70.53 -42.2 71.54 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.402 HG12 ' NH2' ' A' ' 66' ' ' ARG . 3.7 mt -67.34 -54.73 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' A' ' 78' ' ' TRP . 58.5 mt -53.37 -53.6 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.575 -0.703 . . . . 0.0 109.973 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -65.81 -41.31 92.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.014 -1.054 . . . . 0.0 109.627 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.48 -32.72 46.08 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.2 mt -88.93 -8.48 54.1 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.379 -1.071 . . . . 0.0 108.991 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 65.32 40.8 4.64 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 109.935 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.2 mt -73.42 119.21 74.67 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.341 -0.85 . . . . 0.0 109.385 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' A' ' 90' ' ' SER . 52.0 Cg_exo -48.44 141.96 18.36 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 121.719 1.613 . . . . 0.0 112.229 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.8 p -59.58 -1.61 0.26 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.286 -0.884 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.499 ' H ' ' C ' ' A' ' 88' ' ' PRO . 83.8 p -66.45 -22.9 66.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.168 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -97.78 107.48 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 120.803 -1.185 . . . . 0.0 109.46 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.456 ' HG1' ' H62' ' B' ' 410' ' ' ' DA' . 43.5 p -78.48 -28.12 46.39 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.8 m -88.67 29.58 0.99 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.675 -0.64 . . . . 0.0 109.358 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.67 -66.64 0.46 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -50.8 -53.5 31.45 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.457 -0.777 . . . . 0.0 109.501 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.471 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 13.8 tp -57.36 -45.43 84.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 109.049 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 49.6 m -60.2 -40.34 89.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.155 -0.966 . . . . 0.0 108.744 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.9 mt -70.8 -47.16 60.94 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.493 -0.754 . . . . 0.0 110.009 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.507 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 39.8 ttm180 -62.89 -51.87 65.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.003 -1.061 . . . . 0.0 111.3 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.1 m -56.7 -54.84 41.53 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.05 -1.031 . . . . 0.0 110.531 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.56 -41.87 99.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.359 -0.838 . . . . 0.0 111.264 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.417 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.5 t80 -57.88 -40.53 80.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.576 -1.328 . . . . 0.0 109.521 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.3 ttm -52.82 -55.32 23.88 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.415 -0.803 . . . . 0.0 110.999 -178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -73.36 -53.37 10.93 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.874 -1.141 . . . . 0.0 112.882 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -84.6 -46.99 10.99 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -174.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 8.3 mp -97.45 -8.7 28.74 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.148 -1.595 . . . . 0.0 114.23 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.655 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 14.3 t80 -60.49 -38.37 56.65 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 119.725 -1.859 . . . . 0.0 109.099 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 52.5 Cg_exo -58.7 -59.74 0.44 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.578 2.186 . . . . 0.0 112.81 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.413 ' CD2' HD13 ' A' ' 32' ' ' LEU . 8.8 t80 -59.17 -40.86 86.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.614 -0.679 . . . . 0.0 109.518 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -69.99 -46.03 66.05 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.457 -0.777 . . . . 0.0 110.4 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ASN . 17.0 t -76.99 -45.62 26.72 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.234 -0.916 . . . . 0.0 109.912 -179.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HG2' ' CZ ' ' A' ' 35' ' ' PHE . 51.3 tp10 -66.3 -49.81 65.78 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.245 -0.909 . . . . 0.0 111.266 -178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 28.9 mmtm -74.2 -29.34 61.7 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.971 -1.081 . . . . 0.0 111.545 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -125.04 -28.11 3.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.897 -1.127 . . . . 0.0 111.703 -177.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 111' ' ' CYS . 55.1 t30 56.28 47.5 19.08 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.666 -1.271 . . . . 0.0 110.619 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 61.8 mt -69.02 -30.06 68.37 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.178 -0.951 . . . . 0.0 110.846 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 8.1 t -154.16 -165.94 2.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.017 -1.052 . . . . 0.0 111.092 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 70.6 p -130.48 155.49 81.01 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.562 -0.711 . . . . 0.0 109.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.54 -40.09 64.08 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.862 1.708 . . . . 0.0 112.526 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.99 89.24 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.836 -1.165 . . . . 0.0 109.384 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -66.36 -42.71 87.66 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.483 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 16.3 tp -68.75 -51.45 41.11 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.557 -0.714 . . . . 0.0 110.212 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -58.94 -45.08 91.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.936 -1.103 . . . . 0.0 109.365 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.66 -42.46 98.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.131 -0.981 . . . . 0.0 110.327 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.91 -32.21 72.53 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 122.094 0.95 . . . . 0.0 108.728 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.457 HG22 HD12 ' A' ' 126' ' ' ILE . 4.9 mt -64.53 -51.4 68.27 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -63.72 -38.77 92.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 109.381 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -59.9 -34.02 81.13 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.676 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -93.46 -35.49 12.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.138 -1.213 . . . . 0.0 110.117 -179.329 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.676 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.9 mtp180 -68.11 152.19 45.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.933 -1.104 . . . . 0.0 109.735 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.2 mmm180 -60.11 171.12 1.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.305 -0.872 . . . . 0.0 109.635 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -132.55 -152.76 0.51 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.56 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.997 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.004 0 O4'-C1'-C2' 108.291 1.991 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.108 0 O4'-C4'-C3' 107.9 2.3 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.496 1.896 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O5'-C5'-C4' 113.274 2.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.263 0 O5'-C5'-C4' 113.204 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.995 0 O5'-C5'-C4' 113.148 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 112.926 1.947 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.597 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.174 0 C4'-C3'-C2' 105.307 2.107 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O5'-C5'-C4' 113.313 2.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . 0.456 ' H62' ' HG1' ' A' ' 92' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.397 0 O4'-C4'-C3' 107.818 2.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.059 0 O5'-C5'-C4' 113.348 2.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.932 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.803 0 O4'-C4'-C3' 107.875 2.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.681 0 O5'-C5'-C4' 112.667 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.85 0 O4'-C4'-C3' 108.019 2.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.433 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.423 -2.065 0 O4'-C1'-C2' 107.956 1.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.433 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.605 0 O5'-C5'-C4' 113.625 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.45 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.774 0 O4'-C4'-C3' 107.348 1.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.45 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.593 0 O5'-C5'-C4' 113.761 2.543 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.445 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.525 1.693 0 O4'-C4'-C3' 107.851 2.251 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.531 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.768 0 O4'-C4'-C3' 107.53 1.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.531 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O5'-C5'-C4' 113.548 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O5'-C5'-C4' 113.48 2.343 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.02 0 O4'-C1'-C2' 108.728 2.389 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.949 0 O4'-C4'-C3' 108.162 2.562 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.972 0 O4'-C4'-C3' 107.68 2.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.536 0 O4'-C4'-C3' 107.854 2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.668 0 O4'-C4'-C3' 107.593 1.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.135 0 O4'-C4'-C3' 107.955 2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.247 0 C1'-O4'-C4' 106.487 -2.295 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.436 ' N ' ' NH2' ' A' ' 45' ' ' ARG . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.499 ' NE1' ' OE1' ' A' ' 9' ' ' GLN . 66.8 t90 -119.85 80.93 1.65 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.381 -1.07 . . . . 0.0 109.315 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.418 ' OG ' ' CG ' ' A' ' 8' ' ' GLU . 76.1 p -108.35 145.62 34.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.372 -0.83 . . . . 0.0 109.881 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -57.73 -44.69 86.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.638 -0.664 . . . . 0.0 111.247 -178.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.48 -42.72 98.56 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.735 -1.228 . . . . 0.0 110.014 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.418 ' CG ' ' OG ' ' A' ' 5' ' ' SER . 96.4 mt-10 -57.68 -44.75 86.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.139 -0.976 . . . . 0.0 110.062 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 38.3 mt-30 -66.71 -37.94 85.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.97 -1.081 . . . . 0.0 109.434 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -49.73 -50.52 43.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -62.58 -37.2 85.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.108 -0.995 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.43 -52.64 51.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.979 -1.075 . . . . 0.0 111.969 -178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.7 p -68.87 -33.85 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 120.824 -1.173 . . . . 0.0 110.567 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -67.32 -36.4 81.4 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.053 -1.655 . . . . 0.0 108.702 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.408 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 12.3 mm-40 -59.16 -28.98 67.1 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 mt -67.66 -42.32 82.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.398 -0.814 . . . . 0.0 111.634 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -76.32 -33.75 59.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.37 -1.456 . . . . 0.0 109.634 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.496 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.7 mm-40 -62.62 -31.56 72.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.025 -1.047 . . . . 0.0 110.243 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.496 ' C ' ' O ' ' A' ' 18' ' ' GLU . 32.2 mt -36.98 -40.69 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.737 -0.602 . . . . 0.0 110.312 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.24 161.37 5.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.857 -1.152 . . . . 0.0 110.256 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -92.13 73.78 5.47 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -110.93 137.51 20.88 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -71.78 -62.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.251 1.967 . . . . 0.0 112.643 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -58.0 -33.64 69.15 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.056 -1.027 . . . . 0.0 109.276 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.426 HH22 HG22 ' A' ' 19' ' ' ILE . 58.0 ttt180 -61.87 -41.08 97.44 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.862 -1.149 . . . . 0.0 109.994 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -59.8 -59.57 5.22 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.016 -1.052 . . . . 0.0 109.883 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 7.8 pt-20 -53.15 -29.85 33.72 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.551 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -64.55 -61.98 1.87 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.06 . . . . 0.0 109.996 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.489 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 55.1 mt -53.63 -45.88 70.28 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.349 -0.844 . . . . 0.0 109.557 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -65.56 -49.52 68.57 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.519 -179.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.599 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 57.2 t0 -64.87 -39.85 94.19 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.189 -0.945 . . . . 0.0 109.001 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.7 tp -60.76 -49.7 76.44 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.155 -1.018 . . . . 0.0 109.058 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.489 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.7 m-85 -61.55 -35.3 77.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.6 t -68.08 -54.49 17.82 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.523 -0.735 . . . . 0.0 109.576 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.91 -40.85 85.76 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.227 -0.92 . . . . 0.0 109.722 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.418 ' CE ' ' O ' ' A' ' 41' ' ' THR . 75.2 mmm -60.36 -38.15 82.94 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.577 -0.702 . . . . 0.0 110.013 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -61.85 -39.19 90.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.125 -0.985 . . . . 0.0 109.375 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -64.43 -50.53 67.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.923 . . . . 0.0 111.292 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.416 ' NE ' ' HB2' ' A' ' 108' ' ' PRO . 0.9 OUTLIER -63.69 -18.84 64.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.931 -1.106 . . . . 0.0 111.421 -177.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 4.18 61.36 Favored Glycine 0 N--CA 1.482 1.736 0 N-CA-C 107.746 -2.142 . . . . 0.0 107.746 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.418 ' O ' ' CE ' ' A' ' 36' ' ' MET . 19.4 p -114.62 83.38 8.85 Favored Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.37 151.38 13.56 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.729 2.286 . . . . 0.0 111.235 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.439 HD11 HG23 ' A' ' 43' ' ' ILE . 18.3 mt -89.11 103.46 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 110.724 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 4.0 m120 -63.54 -74.51 0.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' NH2' ' N ' ' A' ' 3' ' ' GLY . 7.2 mtt180 -116.56 135.26 53.96 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.6 mt -69.15 144.43 95.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.224 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -65.82 134.88 39.2 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 121.2 1.267 . . . . 0.0 108.974 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.532 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.1 mt -102.37 145.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.024 -1.048 . . . . 0.0 110.242 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.478 ' O ' ' CB ' ' A' ' 50' ' ' ALA . 75.6 mtp -142.73 119.3 11.04 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.478 ' CB ' ' O ' ' A' ' 49' ' ' MET . . . 71.8 39.13 0.88 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.4 mttm 59.77 24.27 13.21 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.242 0.544 . . . . 0.0 109.79 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.5 p -138.8 159.42 42.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.376 -0.827 . . . . 0.0 109.267 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 148.19 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.001 -1.062 . . . . 0.0 109.738 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 63.6 tp -76.17 121.23 22.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.508 -0.745 . . . . 0.0 109.668 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.403 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.8 m-20 -65.04 93.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.378 -0.826 . . . . 0.0 109.162 -179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.9 mt -56.15 -25.22 45.52 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.287 -0.883 . . . . 0.0 109.341 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -81.32 -58.74 2.91 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.2 -0.938 . . . . 0.0 111.759 -179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.37 -36.81 71.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.417 -1.427 . . . . 0.0 109.257 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.0 tp -61.63 -47.48 85.22 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.452 ' O ' ' C ' ' A' ' 61' ' ' ASN . 56.2 t80 -58.81 -70.09 0.16 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 60' ' ' TYR . 63.2 t30 -40.48 -39.31 0.99 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.443 -0.786 . . . . 0.0 109.708 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.6 -50.73 56.83 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.411 HG22 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -57.01 -42.41 79.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.696 -0.628 . . . . 0.0 110.256 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.419 HG22 HD13 ' A' ' 64' ' ' ILE . 5.2 mm -70.15 -29.03 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.21 -29.49 61.03 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.547 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.1 mmt180 -91.61 -4.41 55.31 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.612 -1.305 . . . . 0.0 108.78 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.66 19.63 59.61 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.332 177.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.42 130.31 2.47 Favored Glycine 0 N--CA 1.498 2.811 0 O-C-N 120.28 -1.718 . . . . 0.0 111.475 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.7 tp -50.44 -39.76 48.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.584 -0.951 . . . . 0.0 110.464 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.02 -43.36 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.006 -1.059 . . . . 0.0 109.691 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -57.68 -39.38 77.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.863 -1.148 . . . . 0.0 109.448 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.6 t -62.38 -42.24 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.365 -0.834 . . . . 0.0 109.516 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.8 mt -66.41 -55.66 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 120.851 -1.156 . . . . 0.0 110.692 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -57.17 -42.0 80.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.02 -1.05 . . . . 0.0 110.351 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -94.58 -8.74 37.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.254 -0.904 . . . . 0.0 110.596 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.618 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.9 mttp 57.3 59.11 3.5 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.291 -0.881 . . . . 0.0 109.513 -177.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -88.29 12.89 12.8 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.011 -1.076 . . . . 0.0 108.77 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.502 ' O ' ' N ' ' A' ' 82' ' ' ILE . 71.3 m95 -63.24 -41.04 99.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.16 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' TRP . 15.5 mm100 -49.37 -38.7 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.292 -1.505 . . . . 0.0 108.53 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.671 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.7 mm-40 -71.32 -45.87 61.98 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 108.896 178.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -64.69 -51.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.502 ' N ' ' O ' ' A' ' 78' ' ' TRP . 77.9 mt -52.35 -54.75 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -66.64 -40.93 88.92 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.138 -0.976 . . . . 0.0 109.555 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.44 -32.29 37.66 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.4 mt -89.84 -7.88 53.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.402 -1.058 . . . . 0.0 108.801 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 64.66 42.06 4.94 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.604 -0.685 . . . . 0.0 110.618 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.5 mt -74.42 142.54 78.23 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.081 -1.012 . . . . 0.0 109.224 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.601 ' C ' ' H ' ' A' ' 90' ' ' SER . 51.7 Cg_endo -72.13 142.16 37.52 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.158 1.906 . . . . 0.0 112.163 179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.1 t -56.49 0.99 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 109.761 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 88' ' ' PRO . 19.4 m -65.8 -31.35 72.28 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.107 -0.995 . . . . 0.0 109.838 -178.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.421 HG21 HD13 ' A' ' 91' ' ' ILE . 83.2 mt -93.93 98.26 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 120.822 -1.174 . . . . 0.0 109.486 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.9 p -69.84 -27.94 65.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 108.735 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.9 m -91.23 32.67 1.02 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.519 -0.738 . . . . 0.0 109.164 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.414 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -61.37 -65.52 0.68 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.09 -1.006 . . . . 0.0 108.727 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.77 -52.05 34.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 109.216 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.53 -43.51 89.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.861 -1.149 . . . . 0.0 109.055 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.6 m -60.56 -39.9 89.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.058 -1.026 . . . . 0.0 108.642 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mt -70.2 -46.72 63.99 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.594 -0.691 . . . . 0.0 110.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.497 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 36.9 ttm180 -66.63 -50.92 61.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.066 . . . . 0.0 111.004 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.1 m -55.88 -50.99 69.13 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.967 -1.093 . . . . 0.0 109.026 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -64.31 -43.67 93.99 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.093 -1.005 . . . . 0.0 111.503 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.411 ' CE2' HG22 ' A' ' 63' ' ' VAL . 3.3 t80 -58.75 -41.01 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.274 -1.516 . . . . 0.0 108.859 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.61 ' SD ' ' CD2' ' A' ' 122' ' ' LEU . 42.9 mmm -51.97 -59.49 4.28 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.677 -0.639 . . . . 0.0 111.357 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.663 ' HZ1' ' CB ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -73.62 -50.38 21.37 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.543 -1.348 . . . . 0.0 113.196 -177.372 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 105' ' ' TYR . 57.6 m-85 -82.0 -47.0 13.19 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -174.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.459 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 9.3 mp -104.28 6.19 35.2 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.394 -1.441 . . . . 0.0 114.044 -176.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.511 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 48.1 t80 -65.05 -40.29 44.56 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 119.892 -1.755 . . . . 0.0 111.475 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.499 ' O ' ' N ' ' A' ' 112' ' ' GLU . 83.5 Cg_endo -77.79 -40.98 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 121.687 1.591 . . . . 0.0 113.317 -179.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.59 -43.52 89.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.884 -1.135 . . . . 0.0 108.109 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -68.27 -54.61 16.36 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.517 -0.739 . . . . 0.0 109.932 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' A' ' 115' ' ' ASN . 91.8 m -70.62 -43.15 69.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.866 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.0 tp10 -67.09 -49.5 64.82 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.715 -1.24 . . . . 0.0 110.83 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -76.18 -27.28 56.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.044 -1.035 . . . . 0.0 111.036 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -125.12 -27.3 3.55 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.974 -1.079 . . . . 0.0 111.954 -177.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.568 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.4 t30 58.72 45.23 16.05 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.523 -1.361 . . . . 0.0 110.376 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 87.4 mt -67.82 -32.0 72.25 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.037 -1.04 . . . . 0.0 110.871 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.494 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 26.0 t -153.23 -167.71 2.8 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 119.009 -1.076 . . . . 0.0 111.292 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 81.2 p -124.5 161.61 47.14 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.605 -0.684 . . . . 0.0 110.137 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.507 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 23.3 Cg_exo -59.83 -40.97 58.53 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.602 1.535 . . . . 0.0 112.36 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.77 -37.11 86.15 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.143 -0.973 . . . . 0.0 109.871 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.494 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.69 -46.19 73.01 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.61 ' CD2' ' SD ' ' A' ' 103' ' ' MET . 11.4 tp -66.47 -52.08 49.96 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.485 -0.759 . . . . 0.0 109.879 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.25 -45.84 87.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.129 -0.982 . . . . 0.0 109.629 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.41 87.78 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.25 -0.906 . . . . 0.0 109.873 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.33 -33.33 74.11 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.231 -0.918 . . . . 0.0 108.907 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.402 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 8.0 mt -65.44 -48.96 81.05 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -64.0 -38.72 92.1 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.446 -0.784 . . . . 0.0 109.138 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.5 -34.08 84.17 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -95.14 -35.19 11.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.122 -1.222 . . . . 0.0 110.598 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 53.7 mtp180 -68.88 156.54 38.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.75 -1.218 . . . . 0.0 109.69 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.504 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.4 mpt_? -58.98 150.32 24.86 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -106.22 125.97 51.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.399 -0.813 . . . . 0.0 109.216 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.869 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.419 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.427 -1.691 0 O4'-C1'-C2' 107.791 1.537 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.609 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O4'-C1'-C2' 108.66 2.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C4'-C3' 107.38 1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.84 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 O5'-C5'-C4' 113.148 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . 0.407 ' C5 ' ' C4 ' ' B' ' 407' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.332 0 O5'-C5'-C4' 112.949 1.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . 0.407 ' C4 ' ' C5 ' ' B' ' 406' ' ' ' DA' . . . . . . . . 0 P--O5' 1.614 2.108 0 O5'-C5'-C4' 113.104 2.074 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.532 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.31 0 O4'-C1'-C2' 108.564 2.24 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . 0.492 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.294 0 O5'-C5'-C4' 113.052 2.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O5'-C5'-C4' 113.441 2.315 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.754 0 O5'-C5'-C4' 113.176 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.798 0 O5'-C5'-C4' 113.804 2.574 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.7 0 O4'-C4'-C3' 107.971 2.371 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.744 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.855 0 O4'-C4'-C3' 108.03 2.43 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.844 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.911 0 O4'-C1'-C2' 109.041 2.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.176 0 O4'-C4'-C3' 108.018 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.405 ' C2 ' ' C2 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O5'-C5'-C4' 112.808 1.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.405 ' C2 ' ' C2 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.761 0 O5'-C5'-C4' 113.9 2.643 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.508 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.758 2.158 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.599 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.24 0 O5'-C5'-C4' 113.473 2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.599 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.128 0 O5'-C5'-C4' 113.473 2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . 0.492 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.979 0 O5'-C5'-C4' 113.283 2.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.358 0 O4'-C1'-C2' 108.875 2.523 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.313 0 O5'-C5'-C4' 113.615 2.439 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.533 0 O4'-C4'-C3' 107.472 1.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.67 0 O4'-C4'-C3' 107.796 2.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.011 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O4'-C4'-C3' 107.819 2.219 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.027 0 O4'-C4'-C3' 107.532 1.932 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.509 ' CE3' ' OD1' ' A' ' 44' ' ' ASN . 35.7 p90 -67.37 152.96 44.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.328 -1.101 . . . . 0.0 109.385 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.5 p -103.07 141.76 35.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.328 -0.858 . . . . 0.0 109.852 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -55.99 -34.72 66.04 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.665 -0.647 . . . . 0.0 111.205 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.25 -44.83 95.66 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.735 -1.228 . . . . 0.0 109.581 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -57.43 -43.36 83.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.112 -0.992 . . . . 0.0 109.523 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.0 mp0 -72.25 -38.89 68.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.277 -0.889 . . . . 0.0 109.851 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.31 -50.9 68.39 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.121 -0.987 . . . . 0.0 109.811 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -62.03 -45.08 95.17 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.09 -1.006 . . . . 0.0 109.66 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -63.71 -47.84 79.52 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.378 -0.826 . . . . 0.0 110.278 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 m -72.78 -36.46 52.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 O-C-N 120.644 -1.285 . . . . 0.0 108.567 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -40.16 75.85 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.492 -1.38 . . . . 0.0 107.761 178.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.401 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.1 OUTLIER -58.79 -30.47 67.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.431 -0.908 . . . . 0.0 108.607 178.247 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.1 mt -71.72 -39.18 70.31 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.415 -0.803 . . . . 0.0 111.661 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.499 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.4 m-85 -76.47 -32.83 58.61 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.402 -1.436 . . . . 0.0 110.29 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.467 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -66.52 -25.85 66.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.899 -1.126 . . . . 0.0 110.386 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.467 ' C ' ' O ' ' A' ' 18' ' ' GLU . 30.3 mt -38.96 -39.72 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 O-C-N 121.605 -0.684 . . . . 0.0 110.397 -179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.2 m120 -171.33 161.84 6.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.739 -1.226 . . . . 0.0 110.315 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -90.5 65.16 6.02 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.47 0.653 . . . . 0.0 109.3 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -111.9 103.22 55.04 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.502 -0.749 . . . . 0.0 109.136 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -47.83 -43.47 29.2 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.015 1.81 . . . . 0.0 111.957 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -61.62 -38.48 87.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.19 -0.944 . . . . 0.0 108.535 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.641 ' CG ' HH11 ' A' ' 25' ' ' ARG . 0.5 OUTLIER -60.36 -44.53 95.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.5 -0.75 . . . . 0.0 109.389 179.89 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.3 -53.54 53.59 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 0.0 109.77 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -52.74 -39.05 61.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.432 -0.793 . . . . 0.0 109.175 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -61.12 -63.01 1.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.325 -0.859 . . . . 0.0 109.858 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.401 HD11 ' NH1' ' A' ' 25' ' ' ARG . 43.7 mt -56.2 -44.72 79.75 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.585 -0.697 . . . . 0.0 109.521 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 79.3 m-20 -61.93 -46.53 88.94 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.704 -0.798 . . . . 0.0 109.121 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -66.59 -42.91 86.21 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.7 tp -61.07 -49.3 77.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 0.0 110.658 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -60.43 -36.44 78.19 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.284 -1.51 . . . . 0.0 107.528 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.3 t -69.93 -53.27 18.64 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.508 -0.745 . . . . 0.0 109.478 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -58.73 -42.38 88.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 111.17 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.446 ' CE ' ' O ' ' A' ' 41' ' ' THR . 63.4 mmm -56.49 -38.2 71.41 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.142 -0.974 . . . . 0.0 110.915 -178.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -55.68 -40.18 71.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.765 -1.209 . . . . 0.0 108.499 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -64.91 -39.54 93.67 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.884 0.85 . . . . 0.0 108.739 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -64.31 -30.52 71.57 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.522 -0.736 . . . . 0.0 109.265 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.26 -0.83 60.3 Favored Glycine 0 N--CA 1.485 1.948 0 N-CA-C 108.152 -1.979 . . . . 0.0 108.152 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.446 ' O ' ' CE ' ' A' ' 36' ' ' MET . 44.9 p -120.27 84.37 34.44 Favored Pre-proline 0 N--CA 1.488 1.445 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.76 141.93 11.1 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.439 2.093 . . . . 0.0 110.915 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.4 mt -78.8 101.23 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 120.928 -1.107 . . . . 0.0 110.159 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.509 ' OD1' ' CE3' ' A' ' 4' ' ' TRP . 3.1 m120 -82.91 -4.09 57.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.652 HH21 ' HH ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -170.4 124.45 0.71 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.583 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 2.3 mt -73.09 147.56 88.3 Favored Pre-proline 0 C--N 1.291 -1.971 0 O-C-N 121.412 -0.805 . . . . 0.0 109.243 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -73.78 133.45 18.57 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.526 1.484 . . . . 0.0 108.999 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.603 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 42.2 mt -101.0 142.51 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.777 -1.202 . . . . 0.0 110.509 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.403 ' N ' HG21 ' A' ' 48' ' ' ILE . 79.0 mtp -135.07 121.69 20.72 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 66.48 41.42 3.2 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 56.94 22.84 7.58 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.369 0.604 . . . . 0.0 109.681 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -132.79 148.44 52.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.399 -0.813 . . . . 0.0 109.14 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 10.2 m -67.0 145.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.895 -1.128 . . . . 0.0 108.955 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.9 tp -77.11 122.57 25.17 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.307 -0.871 . . . . 0.0 109.795 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -65.84 90.96 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.525 -0.735 . . . . 0.0 109.565 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.3 -24.33 28.08 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 120.877 -1.139 . . . . 0.0 109.438 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.592 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 43.6 t80 -77.98 -59.35 2.82 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.227 -0.92 . . . . 0.0 111.654 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -60.22 -38.36 83.15 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.834 -1.166 . . . . 0.0 110.615 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.1 tp -58.5 -45.03 89.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 178.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.451 ' O ' ' N ' ' A' ' 63' ' ' VAL . 43.7 t80 -57.04 -68.43 0.23 Allowed 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.645 ' N ' HD21 ' A' ' 61' ' ' ASN . 1.2 m120 -39.91 -42.21 1.3 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.613 -0.679 . . . . 0.0 111.142 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.609 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.7 mt -69.47 -44.31 71.44 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.116 -1.433 . . . . 0.0 107.314 179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.451 ' N ' ' O ' ' A' ' 60' ' ' TYR . 34.8 t -58.43 -44.04 87.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 121.261 -0.9 . . . . 0.0 110.288 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.431 ' CD1' ' CE2' ' A' ' 60' ' ' TYR . 1.2 mm -69.42 -34.11 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.386 -1.446 . . . . 0.0 107.986 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.11 28.02 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 120.096 -0.641 . . . . 0.0 109.562 -178.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.61 HH21 ' CB ' ' A' ' 80' ' ' GLU . 7.5 mmt-85 -92.95 -4.39 52.81 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.678 -1.264 . . . . 0.0 108.898 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 19.05 62.63 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.058 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.23 128.17 2.19 Favored Glycine 0 N--CA 1.5 2.942 0 O-C-N 120.342 -1.681 . . . . 0.0 111.815 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.1 tp -48.93 -39.34 25.87 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.601 -0.941 . . . . 0.0 109.723 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 92.8 t -58.82 -43.11 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 109.805 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -56.01 -40.78 73.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.0 109.208 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 48.0 t -60.97 -43.95 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.392 -0.818 . . . . 0.0 109.216 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 88.4 mt -66.57 -56.36 14.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 O-C-N 121.043 -1.036 . . . . 0.0 110.572 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.75 -42.83 79.98 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.991 -1.068 . . . . 0.0 110.322 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -93.28 -8.97 40.63 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.089 -1.007 . . . . 0.0 110.223 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 24.3 mtmm 57.93 60.71 2.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 0.0 109.387 -178.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.0 mt -91.2 14.76 13.39 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.4 ' O ' ' C ' ' A' ' 79' ' ' GLN . 83.0 m95 -63.73 -39.79 95.17 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.389 -0.82 . . . . 0.0 109.132 179.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 78' ' ' TRP . 77.6 mm-40 -50.49 -39.09 47.45 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.456 -1.403 . . . . 0.0 108.252 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.61 ' CB ' HH21 ' A' ' 66' ' ' ARG . 97.6 mt-10 -69.62 -43.14 73.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.45 -51.96 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 85.6 mt -52.36 -51.59 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -0.884 . . . . 0.0 108.866 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.11 -41.63 85.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.198 -0.939 . . . . 0.0 109.688 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.05 -31.53 40.55 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.3 mt -89.38 -8.83 52.31 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.477 -1.014 . . . . 0.0 109.004 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 61.49 40.4 13.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -73.46 141.15 79.7 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.576 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.8 Cg_endo -67.48 138.37 45.81 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 121.884 1.723 . . . . 0.0 112.155 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.7 t -56.1 -0.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.297 -0.877 . . . . 0.0 110.035 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.576 ' H ' ' C ' ' A' ' 88' ' ' PRO . 16.0 m -64.87 -30.82 71.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 109.718 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.409 HG23 ' N ' ' A' ' 94' ' ' ALA . 68.7 mt -93.22 101.32 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.923 -1.111 . . . . 0.0 109.406 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -72.79 -28.02 62.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.076 -1.015 . . . . 0.0 108.662 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.4 m -89.56 30.05 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.409 ' N ' HG23 ' A' ' 91' ' ' ILE . . . -60.06 -65.35 0.69 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.59 -52.62 29.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.451 -0.78 . . . . 0.0 109.607 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.426 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 6.0 tp -58.79 -43.99 90.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.872 -1.142 . . . . 0.0 109.304 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 m -60.17 -38.63 83.79 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.097 -1.002 . . . . 0.0 108.597 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.8 mt -70.8 -46.5 62.72 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.614 -0.678 . . . . 0.0 109.85 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.531 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.0 ttm180 -65.87 -51.35 59.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 111.179 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.408 ' H ' ' HG1' ' A' ' 100' ' ' THR . 4.5 m -55.94 -53.39 57.39 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 110.108 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -63.09 -41.14 99.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.171 -0.956 . . . . 0.0 111.273 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.401 ' CE2' HG22 ' A' ' 63' ' ' VAL . 2.8 t80 -57.03 -41.44 78.62 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.112 -1.617 . . . . 0.0 109.447 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.496 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.0 OUTLIER -55.94 -55.54 31.4 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.387 -0.82 . . . . 0.0 112.157 -178.612 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -70.94 -53.27 15.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 120.84 -1.163 . . . . 0.0 112.702 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.652 ' HH ' HH21 ' A' ' 45' ' ' ARG . 55.7 m-85 -84.31 -44.6 13.67 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -175.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 10.1 mp -102.96 6.4 38.89 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.36 -1.463 . . . . 0.0 113.913 -176.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.62 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 49.0 t80 -62.42 -42.79 82.14 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 119.855 -1.778 . . . . 0.0 111.625 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.502 ' O ' ' N ' ' A' ' 112' ' ' GLU . 95.4 Cg_endo -76.96 -41.87 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 121.473 1.448 . . . . 0.0 112.823 -178.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -57.32 -38.97 74.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.82 -1.175 . . . . 0.0 107.981 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.491 ' O ' ' OE1' ' A' ' 110' ' ' GLU . 4.7 tp10 -73.5 -54.8 7.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.608 -0.682 . . . . 0.0 110.282 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.62 ' SG ' ' CE1' ' A' ' 107' ' ' TYR . 98.1 m -73.02 -41.42 64.26 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.318 -0.864 . . . . 0.0 111.16 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.64 -44.8 80.99 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.706 -1.246 . . . . 0.0 110.587 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -74.66 -33.63 62.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.195 -0.941 . . . . 0.0 111.253 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -125.18 -24.37 4.01 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.938 -1.101 . . . . 0.0 111.773 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 111' ' ' CYS . 17.3 t-20 57.01 44.94 21.97 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.631 -1.293 . . . . 0.0 110.23 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 79.6 mt -67.5 -29.62 69.09 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.089 -1.007 . . . . 0.0 110.828 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.492 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 46.5 t -152.66 -169.0 3.21 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.355 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.416 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.4 p -128.84 166.79 22.44 Favored Pre-proline 0 N--CA 1.498 1.974 0 O-C-N 121.593 -0.692 . . . . 0.0 109.61 -178.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -62.88 -40.4 35.54 Favored 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 121.382 1.388 . . . . 0.0 111.908 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.53 87.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.064 -1.023 . . . . 0.0 109.306 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.492 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.4 mt-10 -66.46 -45.63 79.08 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 178.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.414 ' CD1' ' CD1' ' A' ' 73' ' ' ILE . 29.3 tp -66.17 -51.03 61.73 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.352 -0.842 . . . . 0.0 109.972 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -57.26 -46.99 82.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.081 -1.012 . . . . 0.0 109.647 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.498 ' O ' ' OD1' ' A' ' 127' ' ' ASP . . . -61.1 -41.02 95.91 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.299 -0.876 . . . . 0.0 110.082 -179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.63 -34.36 75.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 108.417 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.496 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 10.5 mt -63.94 -49.99 79.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.677 ' OD1' ' N ' ' A' ' 128' ' ' GLY . 18.9 p30 -65.75 -32.58 74.21 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 118.863 -1.135 . . . . 0.0 108.588 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.677 ' N ' ' OD1' ' A' ' 127' ' ' ASP . . . -65.61 -30.23 76.92 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.645 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.69 -35.99 14.6 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.004 -1.291 . . . . 0.0 110.741 -179.082 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.6 mtm180 -62.2 145.81 52.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.783 -1.198 . . . . 0.0 109.266 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.4 mpt_? -67.51 142.01 56.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.352 -0.843 . . . . 0.0 109.736 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -65.21 -22.44 66.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.446 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.963 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.406 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.425 -1.917 0 O4'-C1'-C2' 108.004 1.731 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.47 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C1'-C2' 108.506 2.187 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.937 0 O4'-C4'-C3' 107.429 1.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.438 0 O5'-C5'-C4' 113.377 2.269 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.991 0 O5'-C5'-C4' 113.134 2.095 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O5'-C5'-C4' 113.135 2.096 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . 0.543 ' P ' HH11 ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.693 0 O5'-C5'-C4' 112.87 1.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.603 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.431 -1.331 0 O4'-C4'-C3' 107.927 2.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.179 2.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.079 0 O4'-C1'-C2' 108.622 2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.004 0 O5'-C5'-C4' 112.979 1.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.898 0 O4'-C4'-C3' 107.833 2.233 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.883 0 O4'-C4'-C3' 107.825 2.225 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.789 0 O4'-C4'-C3' 107.455 1.855 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.981 2.381 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.424 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.267 0 O4'-C1'-C2' 107.676 1.433 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . 0.424 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C4'-C3' 108.097 2.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.318 1.718 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.345 0 O5'-C5'-C4' 113.529 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.546 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.831 0 O4'-C4'-C3' 107.839 2.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.426 ' C7 ' ' CD2' ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O5'-C5'-C4' 113.145 2.104 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.208 0 O5'-C5'-C4' 113.497 2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.046 0 O5'-C5'-C4' 113.287 2.205 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.162 0 O4'-C1'-C2' 108.67 2.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.168 0 O4'-C4'-C3' 108.088 2.488 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O4'-C4'-C3' 107.657 2.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.365 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.952 0 O4'-C4'-C3' 107.746 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.933 0 O4'-C4'-C3' 107.746 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.972 0 O4'-C4'-C3' 107.531 1.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.582 ' NE1' ' OE1' ' A' ' 9' ' ' GLN . 44.1 p90 -149.96 167.54 26.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 108.919 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.24 135.99 42.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.038 -1.039 . . . . 0.0 110.063 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -54.94 -34.41 63.2 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.606 -0.684 . . . . 0.0 109.829 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.37 -44.21 95.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.873 -1.142 . . . . 0.0 108.971 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -57.14 -45.48 83.51 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.215 -0.928 . . . . 0.0 109.027 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.582 ' OE1' ' NE1' ' A' ' 4' ' ' TRP . 38.9 mt-30 -70.52 -36.82 73.96 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.118 -0.989 . . . . 0.0 109.09 178.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -48.24 -47.27 35.93 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.476 -0.765 . . . . 0.0 109.606 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -62.14 -41.85 98.67 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.162 -0.961 . . . . 0.0 108.687 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.78 -52.95 38.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.683 -0.635 . . . . 0.0 111.454 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -37.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.989 -1.069 . . . . 0.0 109.959 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.1 tpp180 -60.19 -39.5 86.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.083 -1.636 . . . . 0.0 108.214 178.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -58.3 -30.71 66.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mt -68.08 -39.46 82.92 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.457 -0.777 . . . . 0.0 111.529 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.49 ' HH ' ' N ' ' A' ' 30' ' ' ASP . 90.8 m-85 -77.52 -37.67 50.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.357 -1.464 . . . . 0.0 110.289 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.488 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.1 -27.82 69.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.119 -0.988 . . . . 0.0 111.132 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.488 ' C ' ' O ' ' A' ' 18' ' ' GLU . 16.5 mt -36.1 -40.18 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.592 -0.693 . . . . 0.0 110.578 -178.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.566 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.69 167.74 5.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.836 -1.165 . . . . 0.0 110.356 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 53.6 p30 -90.53 65.39 6.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.575 -0.703 . . . . 0.0 110.707 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.89 136.01 19.6 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.955 . . . . 0.0 108.46 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.503 ' O ' ' OE1' ' A' ' 27' ' ' GLU . 67.4 Cg_endo -75.72 -62.61 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.049 1.833 . . . . 0.0 112.656 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 23' ' ' PRO . 22.8 tptp -55.02 -36.82 65.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.416 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.54 HH22 ' CG ' ' A' ' 55' ' ' ASP . 57.9 ttt180 -57.31 -38.42 73.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.221 -0.924 . . . . 0.0 109.765 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -60.12 -58.48 8.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.963 . . . . 0.0 109.763 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.503 ' OE1' ' O ' ' A' ' 23' ' ' PRO . 44.2 mp0 -53.4 -33.65 54.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.321 -0.862 . . . . 0.0 109.995 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -60.96 -63.19 1.38 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.155 -0.965 . . . . 0.0 110.896 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.468 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 28.1 mt -56.17 -45.44 79.72 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.037 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.49 ' N ' ' HH ' ' A' ' 17' ' ' TYR . 38.4 m-20 -62.41 -46.21 89.62 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.599 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.405 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 43.3 t0 -66.95 -44.39 80.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.223 -0.923 . . . . 0.0 109.782 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.2 tp -56.51 -47.88 78.41 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 110.267 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.468 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.3 m-85 -61.23 -34.74 75.6 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.311 -1.356 . . . . 0.0 108.385 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 m -69.25 -55.13 11.43 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.274 -0.891 . . . . 0.0 110.457 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.408 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 43.0 t80 -60.36 -37.2 79.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.869 . . . . 0.0 110.921 -179.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.5 mmm -59.44 -37.61 78.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.17 -0.956 . . . . 0.0 110.867 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -62.93 -39.76 95.56 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.962 -1.086 . . . . 0.0 110.82 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -63.39 -36.99 85.53 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.645 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -65.03 -29.04 69.91 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.386 -179.286 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.71 -1.76 63.97 Favored Glycine 0 C--N 1.295 -1.717 0 N-CA-C 107.44 -2.264 . . . . 0.0 107.44 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.4 p -116.93 84.02 15.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -86.59 143.18 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.684 2.256 . . . . 0.0 110.575 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.549 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 20.3 mt -78.73 99.44 3.09 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 120.866 -1.146 . . . . 0.0 109.389 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.433 ' HB3' HH12 ' A' ' 45' ' ' ARG . 89.7 m-20 -67.59 -38.11 83.55 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 178.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.613 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -144.28 130.56 19.72 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 178.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.3 mt -71.46 147.61 92.72 Favored Pre-proline 0 C--N 1.298 -1.647 0 O-C-N 121.287 -0.883 . . . . 0.0 109.504 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.41 138.69 33.25 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 121.685 1.59 . . . . 0.0 109.429 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.586 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 41.3 mt -104.41 143.14 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.044 -1.035 . . . . 0.0 110.379 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.7 mmm -135.35 127.3 29.56 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.58 42.47 17.29 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.2 mttt 59.72 25.62 14.62 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.415 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 82.5 p -138.35 154.71 48.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.1 -1.0 . . . . 0.0 109.794 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.7 m -67.16 144.24 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 120.939 -1.101 . . . . 0.0 109.263 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 60.1 tp -77.59 123.95 27.29 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.533 -0.73 . . . . 0.0 109.848 -179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.54 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.8 m-20 -66.28 90.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.339 -0.851 . . . . 0.0 109.437 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.95 -23.03 11.68 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.053 -1.029 . . . . 0.0 109.174 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.58 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 46.5 t80 -78.91 -58.95 2.98 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.228 -0.92 . . . . 0.0 111.618 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -58.61 -36.46 74.05 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.661 -1.275 . . . . 0.0 109.898 -178.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.0 tp -62.77 -43.0 99.94 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 61' ' ' ASN . 60.7 t80 -61.16 -69.94 0.21 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.815 -0.553 . . . . 0.0 109.56 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.745 HD21 ' H ' ' A' ' 61' ' ' ASN . 1.2 m-80 -42.73 -37.24 1.69 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.323 -0.86 . . . . 0.0 109.732 -179.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.5 mt -67.33 -51.8 48.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.419 ' CG2' ' CE2' ' A' ' 102' ' ' TYR . 38.8 t -57.92 -43.99 85.72 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.702 -0.624 . . . . 0.0 109.605 179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.44 ' CD1' ' OE1' ' A' ' 110' ' ' GLU . 14.2 mm -69.06 -37.88 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -17.55 32.76 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 120.269 -0.573 . . . . 0.0 109.794 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -97.87 4.35 49.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.838 -1.164 . . . . 0.0 109.361 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.61 12.32 80.36 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.107 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 133.2 138.33 4.03 Favored Glycine 0 N--CA 1.504 3.202 0 O-C-N 120.512 -1.581 . . . . 0.0 111.701 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -50.75 -43.07 58.13 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.766 -0.844 . . . . 0.0 111.349 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.8 t -60.03 -42.16 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 120.73 -1.231 . . . . 0.0 110.062 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -55.43 -37.98 68.38 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.012 -1.055 . . . . 0.0 109.313 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 76' ' ' LYS . 54.5 t -64.3 -43.62 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.584 -0.698 . . . . 0.0 109.936 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.435 HD11 HG21 ' A' ' 73' ' ' ILE . 94.5 mt -66.34 -58.2 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.854 -1.153 . . . . 0.0 110.987 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -57.12 -41.48 79.08 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.034 -1.041 . . . . 0.0 110.344 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -93.06 -10.57 35.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.95 . . . . 0.0 110.608 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.598 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.8 mttp 59.18 60.6 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -0.825 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.43 13.39 17.69 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.911 -1.118 . . . . 0.0 108.107 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.45 ' O ' ' N ' ' A' ' 82' ' ' ILE . 85.1 m95 -63.05 -41.32 99.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.352 -0.842 . . . . 0.0 109.398 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 99.3 mm-40 -50.62 -36.7 36.52 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 118.054 -1.458 . . . . 0.0 108.112 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.0 mm-40 -71.17 -43.34 67.66 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.0 mt -67.8 -54.16 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.45 ' N ' ' O ' ' A' ' 78' ' ' TRP . 59.3 mt -53.13 -54.58 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -67.79 -40.55 83.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.174 -0.954 . . . . 0.0 109.32 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.38 -32.22 44.5 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.6 mt -89.57 -7.73 54.22 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.469 -1.018 . . . . 0.0 108.631 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 65.12 40.8 4.85 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.308 0.575 . . . . 0.0 110.097 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 30.1 mt -72.47 148.77 90.81 Favored Pre-proline 0 N--CA 1.489 1.477 0 O-C-N 121.219 -0.926 . . . . 0.0 108.955 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.49 164.61 33.62 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.328 2.019 . . . . 0.0 112.129 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.8 m -82.66 -0.03 45.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.0 108.855 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 m -65.49 -33.4 75.83 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.601 -0.687 . . . . 0.0 110.235 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.436 HG22 HD13 ' A' ' 91' ' ' ILE . 89.3 mt -91.51 100.43 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.672 -1.267 . . . . 0.0 109.312 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 67.1 p -72.24 -23.32 61.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.272 -0.892 . . . . 0.0 109.139 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.0 m -101.55 40.67 1.28 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.492 -0.755 . . . . 0.0 109.156 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -63.08 1.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 108.853 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -46.36 -50.91 15.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.539 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.407 ' O ' ' OG1' ' A' ' 100' ' ' THR . 5.6 tp -58.71 -42.47 88.75 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.788 -1.195 . . . . 0.0 109.171 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.7 m -62.42 -41.17 98.5 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.127 -0.983 . . . . 0.0 108.819 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.5 mt -69.57 -48.35 60.58 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.722 -0.611 . . . . 0.0 109.816 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.711 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -63.35 -51.08 67.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.239 -0.913 . . . . 0.0 110.974 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 6.5 m -55.64 -55.12 35.8 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.236 -0.915 . . . . 0.0 109.792 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -63.3 -42.02 99.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -0.887 . . . . 0.0 111.477 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.419 ' CE2' ' CG2' ' A' ' 63' ' ' VAL . 5.2 t80 -57.83 -40.94 81.21 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.278 -1.514 . . . . 0.0 109.321 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.46 ' CE ' ' CD1' ' A' ' 126' ' ' ILE . 1.5 ttm -53.01 -56.85 12.98 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.555 -0.715 . . . . 0.0 111.566 -178.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mttm -74.58 -52.65 11.22 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.871 -1.143 . . . . 0.0 113.151 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.25 -47.76 11.19 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 11.2 mp -97.11 -3.2 41.61 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.169 -1.582 . . . . 0.0 113.4 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 74.8 t80 -64.14 -35.77 16.72 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 119.981 -1.699 . . . . 0.0 109.876 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 25.7 Cg_exo -63.6 -55.13 0.75 Allowed 'Trans proline' 0 N--CA 1.5 1.888 0 C-N-CA 122.427 2.085 . . . . 0.0 112.545 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.405 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 3.2 t80 -57.82 -46.14 85.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.42 -0.8 . . . . 0.0 109.212 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 64' ' ' ILE . 3.4 tp10 -66.25 -53.57 35.33 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.317 -0.864 . . . . 0.0 109.727 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.6 t -67.24 -45.38 76.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 110.353 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -67.26 -48.91 66.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.165 -0.96 . . . . 0.0 111.379 -178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -73.57 -32.45 64.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.107 -0.996 . . . . 0.0 112.246 -177.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.2 tppt? -125.18 -27.54 3.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.888 -1.132 . . . . 0.0 111.854 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.59 45.47 24.77 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.742 -1.224 . . . . 0.0 110.528 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 72.9 mt -68.05 -28.39 67.34 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.029 -1.044 . . . . 0.0 110.943 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -152.49 -167.01 2.63 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 118.733 -1.187 . . . . 0.0 111.607 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.534 ' N ' ' OG ' ' A' ' 117' ' ' SER . 76.7 p -131.41 158.55 74.98 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.661 -0.649 . . . . 0.0 109.914 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.498 ' N ' ' HH ' ' A' ' 107' ' ' TYR . 31.2 Cg_exo -55.11 -40.4 86.01 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.671 1.581 . . . . 0.0 112.437 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.77 -38.9 92.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.782 -1.199 . . . . 0.0 109.788 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.6 mt-10 -65.09 -41.06 95.34 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.2 tp -69.36 -50.34 47.18 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.684 -0.635 . . . . 0.0 110.219 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -58.35 -46.55 86.03 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.054 -1.028 . . . . 0.0 109.729 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.32 -42.34 98.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.373 -0.829 . . . . 0.0 110.408 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.12 -33.5 74.62 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.087 -1.008 . . . . 0.0 108.429 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.502 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.3 mt -64.67 -49.52 79.95 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.962 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.51 -38.22 86.57 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.78 75.82 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.711 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 29.6 p30 -94.13 -28.25 15.79 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.266 -1.137 . . . . 0.0 110.456 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.1 mtp180 -62.95 142.2 58.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.766 -1.209 . . . . 0.0 109.491 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -66.78 150.63 48.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.488 -0.758 . . . . 0.0 109.656 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -94.23 113.77 25.75 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.259 -0.9 . . . . 0.0 108.959 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.94 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.404 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O4'-C1'-C2' 108.041 1.765 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.688 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C1'-C2' 108.821 2.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.211 0 O4'-C4'-C3' 107.48 1.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.149 0 O4'-C4'-C3' 107.779 2.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.221 0 O5'-C5'-C4' 113.161 2.115 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O5'-C5'-C4' 113.053 2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.937 0 O5'-C5'-C4' 113.263 2.188 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.586 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.311 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.364 0 O5'-C5'-C4' 113.344 2.246 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.195 0 O4'-C1'-C2' 108.554 2.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O5'-C5'-C4' 113.033 2.024 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.175 0 O5'-C5'-C4' 113.359 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O4'-C4'-C3' 107.905 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 O4'-C4'-C3' 107.56 1.96 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O4'-C4'-C3' 107.902 2.302 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.818 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C1'-C2' 108.947 2.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.399 0 O4'-C1'-C2' 108.76 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.139 0 O5'-C5'-C4' 112.895 1.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.844 0 O5'-C5'-C4' 113.839 2.599 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . 0.534 ' OP1' ' NH1' ' A' ' 99' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -1.804 0 O4'-C4'-C3' 107.889 2.289 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.495 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.075 0 O4'-C4'-C3' 107.748 2.148 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.495 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.907 0 O5'-C5'-C4' 113.475 2.339 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.041 0 O5'-C5'-C4' 113.635 2.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C1'-C2' 108.911 2.555 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.08 0 O5'-C5'-C4' 113.424 2.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.215 0 O4'-C4'-C3' 107.624 2.024 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.341 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.582 1.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.13 0 O5'-C5'-C4' 113.187 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.795 0 O4'-C4'-C3' 107.465 1.865 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CZ3' ' ND2' ' A' ' 44' ' ' ASN . 41.3 p90 -65.04 152.0 44.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.353 -1.086 . . . . 0.0 109.718 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 74.2 p -103.25 145.48 29.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.309 -0.869 . . . . 0.0 109.881 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.565 ' C ' ' CD1' ' A' ' 6' ' ' PHE . 0.1 OUTLIER -55.64 -41.88 74.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.634 -0.666 . . . . 0.0 110.449 -178.243 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' N ' ' CG ' ' A' ' 6' ' ' PHE . 96.4 mt-10 -61.83 -45.42 93.9 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.003 -1.061 . . . . 0.0 109.547 -179.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.38 -41.02 96.43 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.257 -0.902 . . . . 0.0 109.566 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.593 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 9.4 mm-40 -74.46 -41.38 60.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.319 -0.863 . . . . 0.0 109.578 179.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -50.91 -47.44 60.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 0.0 109.535 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -61.36 -42.28 98.45 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.179 -0.951 . . . . 0.0 109.469 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -67.0 -51.53 53.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.179 -0.95 . . . . 0.0 111.194 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.7 p -71.74 -39.61 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.256 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -58.92 -38.9 80.02 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.099 -1.626 . . . . 0.0 108.155 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.495 ' NE2' ' OE1' ' A' ' 18' ' ' GLU . 19.3 mm-40 -60.71 -31.32 70.61 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.648 178.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.4 mt -64.55 -39.15 93.23 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 110.734 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -79.57 -34.98 40.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.561 -1.337 . . . . 0.0 109.835 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.495 ' OE1' ' NE2' ' A' ' 15' ' ' GLN . 97.7 mt-10 -64.8 -29.22 70.18 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.063 -1.023 . . . . 0.0 110.601 -178.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.488 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 16.5 mt -37.82 -39.94 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.518 -0.739 . . . . 0.0 110.897 -178.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 0.9 OUTLIER -173.02 164.97 4.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.649 -1.282 . . . . 0.0 110.677 -179.159 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -92.14 67.18 4.99 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.838 -0.539 . . . . 0.0 110.078 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.33 102.87 54.14 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.36 -48.83 14.25 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.952 1.768 . . . . 0.0 112.341 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.04 -37.1 81.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.996 -1.065 . . . . 0.0 108.919 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.593 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.2 ttt-85 -60.33 -42.89 96.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.306 -0.871 . . . . 0.0 109.439 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -62.22 -52.61 63.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.991 -1.068 . . . . 0.0 109.644 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -52.26 -35.04 48.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 0.0 109.288 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.98 -62.69 1.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.639 0.733 . . . . 0.0 110.549 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 14.6 mt -57.38 -43.21 83.42 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.643 -0.661 . . . . 0.0 109.365 -179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -58.94 -50.75 72.88 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.211 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -66.99 -44.03 81.44 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.341 -0.85 . . . . 0.0 110.333 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.411 HD13 ' CD2' ' A' ' 109' ' ' TYR . 62.4 tp -57.96 -50.42 73.44 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.94 . . . . 0.0 110.381 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -60.85 -34.23 74.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.154 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -67.03 -54.66 19.49 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.336 -0.852 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.53 -38.98 86.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.661 -179.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mmm -59.47 -39.41 83.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 111.512 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.739 -1.225 . . . . 0.0 110.783 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -64.96 -44.05 90.66 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.031 -1.043 . . . . 0.0 109.509 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.437 HH11 ' HB3' ' A' ' 108' ' ' PRO . 7.8 mtp180 -63.2 -25.47 68.35 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.963 -177.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.21 0.23 55.91 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 107.977 -2.049 . . . . 0.0 107.977 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 50.1 p -115.61 83.9 11.74 Favored Pre-proline 0 N--CA 1.49 1.56 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -85.08 142.73 8.86 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.647 2.232 . . . . 0.0 111.084 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.437 HG23 HD12 ' A' ' 43' ' ' ILE . 45.2 mt -78.88 94.53 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 C-N-CA 118.795 -1.162 . . . . 0.0 109.329 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.593 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 82.1 m-20 -65.97 -32.89 74.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -151.23 133.28 15.16 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.45 146.76 92.08 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 120.784 -1.197 . . . . 0.0 109.267 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.54 104.16 1.76 Allowed 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 121.636 1.558 . . . . 0.0 109.735 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.59 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 50.2 mt -72.7 142.4 15.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.082 -1.011 . . . . 0.0 110.202 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mmm -138.51 127.96 24.61 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.782 0.801 . . . . 0.0 108.972 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 63.32 40.04 8.94 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 -178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 59.42 22.62 11.1 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.321 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.8 m -137.1 155.4 49.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.182 -0.949 . . . . 0.0 109.512 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 m -65.82 143.4 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.81 -1.181 . . . . 0.0 108.836 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.1 tp -77.76 124.45 27.97 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.17 -0.956 . . . . 0.0 109.135 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -65.17 91.64 0.1 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.569 -0.707 . . . . 0.0 110.045 -178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.3 mt -53.89 -25.14 18.59 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 120.99 -1.068 . . . . 0.0 108.848 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.48 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 46.9 t80 -79.38 -57.85 3.5 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 111.685 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.13 -39.25 91.92 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.659 -1.276 . . . . 0.0 110.153 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.7 tp -60.02 -40.98 91.15 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.829 -1.169 . . . . 0.0 108.352 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -61.56 -67.17 0.43 Allowed 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.48 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 88.0 m-20 -43.06 -39.75 2.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.482 -0.761 . . . . 0.0 111.123 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -70.21 -46.58 64.25 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 117.656 -1.618 . . . . 0.0 107.356 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.489 ' CG2' ' CE2' ' A' ' 102' ' ' TYR . 33.8 t -57.61 -44.49 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 110.566 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.44 HG22 HD13 ' A' ' 64' ' ' ILE . 10.9 mm -70.16 -34.2 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 120.508 -1.37 . . . . 0.0 108.007 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.18 -20.44 26.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.82 -0.55 . . . . 0.0 110.232 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.567 HH21 ' CB ' ' A' ' 80' ' ' GLU . 14.6 mmt-85 -94.53 2.07 55.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.713 -1.242 . . . . 0.0 108.732 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.97 14.4 77.37 Favored Glycine 0 N--CA 1.493 2.438 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.154 177.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.61 2.96 Favored Glycine 0 N--CA 1.501 2.974 0 O-C-N 120.519 -1.577 . . . . 0.0 111.316 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 tp -50.11 -40.91 47.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.65 -0.912 . . . . 0.0 110.754 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.99 -41.54 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.903 -1.123 . . . . 0.0 109.863 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -56.4 -39.84 73.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.995 -1.065 . . . . 0.0 108.877 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 76' ' ' LYS . 98.2 t -64.99 -44.26 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.544 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.44 -52.54 40.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.821 0 O-C-N 120.862 -1.149 . . . . 0.0 110.01 -178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.449 HD22 ' CB ' ' A' ' 125' ' ' ALA . 4.5 m120 -57.73 -42.97 84.95 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.995 -1.066 . . . . 0.0 110.35 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -94.94 -8.88 35.75 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 72' ' ' VAL . 37.7 mtmt 59.04 60.69 2.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.338 -0.851 . . . . 0.0 109.703 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.7 mt -90.9 17.63 7.59 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.443 ' O ' ' N ' ' A' ' 82' ' ' ILE . 97.9 m95 -64.48 -43.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.537 179.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 78' ' ' TRP . 50.8 mt-30 -48.21 -38.83 19.31 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.254 -1.379 . . . . 0.0 108.35 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.567 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.0 mm-40 -66.39 -40.79 89.87 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -72.41 -52.32 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.443 ' N ' ' O ' ' A' ' 78' ' ' TRP . 45.9 mt -52.96 -52.55 27.86 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -72.3 -40.7 67.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.479 -0.763 . . . . 0.0 109.899 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.75 -34.87 45.24 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.8 mt -89.71 -7.96 53.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -1.075 . . . . 0.0 108.888 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 67.22 38.5 3.33 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.34 0.591 . . . . 0.0 109.546 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.66 120.08 78.73 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.407 -0.808 . . . . 0.0 108.967 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.516 ' C ' ' H ' ' A' ' 90' ' ' SER . 50.8 Cg_exo -47.79 139.16 19.51 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.767 1.645 . . . . 0.0 112.694 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 83.4 p -60.84 0.91 0.17 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.344 -0.848 . . . . 0.0 109.887 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.516 ' H ' ' C ' ' A' ' 88' ' ' PRO . 6.0 m -62.7 -33.04 74.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.146 -0.971 . . . . 0.0 109.503 -178.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.456 HG23 HD13 ' A' ' 91' ' ' ILE . 85.7 mt -87.2 101.12 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.826 -1.171 . . . . 0.0 108.937 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 39.1 p -68.18 -29.31 68.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.311 -0.868 . . . . 0.0 109.132 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -94.79 39.96 1.1 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.53 -0.731 . . . . 0.0 109.067 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.404 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -62.77 -64.62 0.86 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.14 -0.975 . . . . 0.0 108.931 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -48.43 -51.98 24.22 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.342 -0.849 . . . . 0.0 109.6 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 6.8 tp -58.61 -47.38 84.52 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.732 -1.23 . . . . 0.0 109.628 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 58.1 m -59.51 -40.1 86.02 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.032 -1.043 . . . . 0.0 108.842 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.6 mt -71.05 -45.45 63.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.659 -0.651 . . . . 0.0 110.255 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -67.28 -50.67 59.42 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.841 -1.162 . . . . 0.0 110.952 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.3 m -55.99 -54.8 40.52 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.163 -0.961 . . . . 0.0 110.081 -178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -61.99 -40.57 96.07 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.105 -0.997 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.489 ' CE2' ' CG2' ' A' ' 63' ' ' VAL . 6.8 t80 -57.58 -39.82 77.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.21 -1.556 . . . . 0.0 109.402 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.7 ttm -55.58 -55.94 26.16 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.393 -0.817 . . . . 0.0 112.246 -178.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -72.85 -52.05 16.34 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.627 -1.296 . . . . 0.0 112.823 -176.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -83.69 -43.19 15.8 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -175.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.459 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 10.0 mp -99.63 -7.25 26.0 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.283 -1.511 . . . . 0.0 114.238 -176.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.652 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 46.5 t80 -62.3 -36.92 31.94 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 119.686 -1.884 . . . . 0.0 109.727 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.652 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.9 Cg_exo -65.69 -56.81 0.29 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.242 1.961 . . . . 0.0 112.091 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.411 ' CD2' HD13 ' A' ' 32' ' ' LEU . 8.6 t80 -59.31 -35.93 74.7 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -71.8 -56.21 6.17 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.732 -0.605 . . . . 0.0 110.309 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.5 OUTLIER -69.96 -41.53 74.36 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.304 -0.872 . . . . 0.0 110.1 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 45.4 tp10 -66.57 -49.52 66.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.261 -0.9 . . . . 0.0 110.799 -178.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -74.67 -30.22 61.52 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.088 -1.008 . . . . 0.0 111.513 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -125.35 -27.63 3.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.004 -1.06 . . . . 0.0 112.115 -177.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' A' ' 111' ' ' CYS . 29.9 t30 57.04 45.42 21.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.579 -1.326 . . . . 0.0 110.065 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.55 -33.24 74.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.116 -0.99 . . . . 0.0 111.431 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.558 ' OG ' ' N ' ' A' ' 118' ' ' THR . 27.6 t -154.28 -166.11 2.27 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.598 -1.241 . . . . 0.0 111.75 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.558 ' N ' ' OG ' ' A' ' 117' ' ' SER . 81.9 p -124.67 152.24 68.88 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.888 -0.508 . . . . 0.0 109.754 -178.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.66 -38.71 91.08 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.2 1.933 . . . . 0.0 112.326 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.65 88.11 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.874 -1.141 . . . . 0.0 109.427 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.494 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 98.2 mt-10 -65.78 -42.09 91.2 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 13.0 tp -67.56 -51.72 47.24 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.686 -0.634 . . . . 0.0 109.871 178.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.12 -45.67 79.44 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.948 -1.095 . . . . 0.0 108.289 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.35 89.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.421 -0.799 . . . . 0.0 109.201 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.449 ' CB ' HD22 ' A' ' 74' ' ' ASN . . . -67.76 -36.63 80.87 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.527 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.9 mt -64.1 -48.72 84.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -62.22 -37.64 86.15 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.957 -1.09 . . . . 0.0 108.256 178.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.65 -33.27 84.43 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.641 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 28.1 p-10 -92.27 -31.63 15.33 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.9 -1.353 . . . . 0.0 110.424 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.641 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 81.8 mtm180 -64.24 144.48 57.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.613 -1.305 . . . . 0.0 109.418 179.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.577 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.5 mpt_? -67.93 149.04 50.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.255 -0.903 . . . . 0.0 109.657 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.35 -10.54 58.35 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.879 0.847 . . . . 0.0 109.228 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.951 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 401' ' ' ' DC' . . . . . 0.417 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.426 -1.777 0 O4'-C1'-C2' 107.843 1.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 402' ' ' ' DC' . . . . . 0.593 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.225 0 O4'-C1'-C2' 108.611 2.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.136 0 O4'-C4'-C3' 107.546 1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.424 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.115 0 O5'-C5'-C4' 112.962 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.096 0 O5'-C5'-C4' 113.043 2.031 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.914 0 O5'-C5'-C4' 113.33 2.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 408' ' ' ' DT' . . . . . 0.59 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.606 1.268 0 C4'-C3'-C2' 105.3 2.1 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.256 0 O5'-C5'-C4' 113.201 2.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.304 0 O5'-C5'-C4' 113.255 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.823 0 O5'-C5'-C4' 113.237 2.169 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.303 0 O5'-C5'-C4' 113.541 2.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.273 0 O4'-C4'-C3' 107.894 2.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.9 0 O4'-C4'-C3' 107.642 2.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.975 0 O4'-C4'-C3' 108.088 2.488 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 416' ' ' ' DC' . . . . . 0.825 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C1'-C2' 109.025 2.659 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.402 0 O4'-C1'-C2' 108.702 2.365 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 418' ' ' ' DA' . . . . . 0.471 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.111 0 O5'-C5'-C4' 112.859 1.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 419' ' ' ' DC' . . . . . 0.471 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.717 0 O5'-C5'-C4' 113.975 2.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.871 0 O4'-C4'-C3' 107.736 2.136 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 421' ' ' ' DT' . . . . . 0.457 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.092 0 O5'-C5'-C4' 113.059 2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 422' ' ' ' DC' . . . . . 0.457 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.101 0 O5'-C5'-C4' 113.691 2.493 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.805 0 O5'-C5'-C4' 113.49 2.35 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.187 0 O4'-C1'-C2' 108.686 2.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.32 0 O4'-C4'-C3' 108.066 2.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.135 0 O4'-C4'-C3' 107.701 2.101 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.607 1.351 0 O4'-C4'-C3' 107.741 2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.613 2.013 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.897 0 O4'-C4'-C3' 107.899 2.299 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.71 0 O4'-C4'-C3' 107.611 2.011 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 44' ' ' ASN . 5.9 mm100 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.18 -49.38 74.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.952 -1.092 . . . . 0.0 109.83 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.6 mtmm -60.74 -35.63 76.84 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.035 -1.041 . . . . 0.0 108.911 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -66.35 -49.99 65.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.55 -0.719 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.28 -35.86 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 120.771 -1.206 . . . . 0.0 108.901 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.572 ' NH1' ' OE2' ' A' ' 18' ' ' GLU . 0.5 OUTLIER -54.83 -40.47 69.61 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.374 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -59.76 -31.64 69.84 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.493 ' HB3' HD13 ' A' ' 29' ' ' LEU . 13.1 mt -70.77 -37.31 73.35 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.354 -0.841 . . . . 0.0 111.129 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.3 m-85 -79.25 -33.0 43.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.487 -1.383 . . . . 0.0 110.329 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.572 ' OE2' ' NH1' ' A' ' 14' ' ' ARG . 97.8 mt-10 -66.24 -30.06 70.43 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.915 -1.115 . . . . 0.0 110.45 -178.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.679 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.9 mt -36.17 -40.39 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 O-C-N 121.719 -0.613 . . . . 0.0 110.687 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -171.68 164.6 6.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.654 -1.279 . . . . 0.0 110.766 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -90.79 65.6 5.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.748 -0.595 . . . . 0.0 110.103 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.569 ' OD1' ' N ' ' A' ' 25' ' ' ARG . 10.8 t70 -112.42 95.72 32.75 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.351 -0.843 . . . . 0.0 108.847 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.46 -41.72 35.92 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.369 2.046 . . . . 0.0 112.217 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -60.06 -41.0 91.42 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.208 -0.932 . . . . 0.0 108.486 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.679 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.4 ttt180 -61.32 -38.96 88.77 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.631 -0.668 . . . . 0.0 110.134 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -59.88 -48.89 79.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.191 -0.943 . . . . 0.0 109.41 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -53.46 -38.49 63.63 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.51 -0.744 . . . . 0.0 109.367 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -64.55 -61.25 2.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.976 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.493 HD13 ' HB3' ' A' ' 16' ' ' LEU . 49.1 mt -55.47 -46.67 76.82 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.334 -0.854 . . . . 0.0 108.781 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -62.0 -49.11 77.36 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.219 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 53.3 t0 -66.7 -42.44 86.42 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -57.89 -50.37 73.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.103 -0.998 . . . . 0.0 110.192 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 46.6 m-85 -61.19 -35.21 76.54 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 118.064 -1.454 . . . . 0.0 107.54 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.529 ' HG ' ' H ' ' A' ' 35' ' ' PHE . 32.3 p -70.76 -53.62 14.78 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.716 0.77 . . . . 0.0 109.371 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.529 ' H ' ' HG ' ' A' ' 34' ' ' SER . 43.9 t80 -57.4 -44.02 84.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.701 -0.624 . . . . 0.0 110.402 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mmm -56.71 -34.46 67.48 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.365 -0.834 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.423 ' C ' ' OE1' ' A' ' 37' ' ' GLN . 5.2 tm0? -54.43 -41.68 69.65 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.402 ' NZ ' ' CD1' ' A' ' 35' ' ' PHE . 6.6 ttpm? -67.07 -40.09 86.97 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.498 -0.751 . . . . 0.0 109.578 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.403 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.8 mmm180 -64.41 -30.76 71.8 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.811 -0.556 . . . . 0.0 109.913 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.24 0.71 65.23 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.1 p -117.17 85.25 18.46 Favored Pre-proline 0 N--CA 1.488 1.44 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -83.47 145.97 12.03 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.537 2.158 . . . . 0.0 111.281 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 15.7 mt -86.9 104.81 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 120.921 -1.112 . . . . 0.0 110.475 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.606 ' O ' ' NE ' ' A' ' 45' ' ' ARG . 79.5 m-20 -85.34 -10.26 56.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.606 ' NE ' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -156.21 117.54 3.86 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.475 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 16' ' ' LEU . 3.2 mt -70.82 138.23 85.44 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 120.463 -1.398 . . . . 0.0 108.949 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -52.76 133.93 52.36 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 N-CA-C 109.391 -1.042 . . . . 0.0 109.391 176.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.425 HG23 ' O ' ' A' ' 52' ' ' SER . 5.8 mt -105.14 149.36 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.967 -1.083 . . . . 0.0 109.775 -179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.64 ' SD ' HD13 ' A' ' 54' ' ' LEU . 22.9 mtt -142.23 120.9 12.59 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.45 41.79 7.22 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 70.9 mttt 60.45 27.13 16.74 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.322 0.582 . . . . 0.0 109.597 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.425 ' O ' HG23 ' A' ' 48' ' ' ILE . 86.6 p -137.33 154.67 50.01 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 109.417 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 m -69.31 147.22 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 109.687 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 49' ' ' MET . 57.4 tp -84.36 127.89 34.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.345 -0.847 . . . . 0.0 109.539 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.588 ' CG ' HH22 ' A' ' 25' ' ' ARG . 4.6 m-20 -66.31 90.33 0.15 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.377 -0.827 . . . . 0.0 109.575 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.7 mt -55.57 -25.27 37.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.976 -1.078 . . . . 0.0 109.601 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -76.3 -54.64 6.49 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.227 -0.921 . . . . 0.0 111.636 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.31 -37.5 83.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.778 -1.201 . . . . 0.0 109.739 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 HD22 ' A' ' 98' ' ' LEU . 53.9 tp -58.8 -44.72 90.86 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.983 -1.073 . . . . 0.0 108.278 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.44 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.6 t80 -56.73 -68.06 0.25 Allowed 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.73 -0.606 . . . . 0.0 109.848 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -42.7 -39.87 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.371 -0.831 . . . . 0.0 111.415 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.416 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 6.1 mt -71.24 -44.35 65.49 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 118.144 -1.422 . . . . 0.0 107.628 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.794 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.4 t -59.16 -46.11 92.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.282 -0.886 . . . . 0.0 109.848 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.44 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -67.98 -35.83 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.711 -1.243 . . . . 0.0 108.414 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.75 -25.82 20.53 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.985 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.611 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.6 mpt_? -91.3 -2.9 57.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.564 -1.335 . . . . 0.0 109.109 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.31 20.55 56.77 Favored Glycine 0 N--CA 1.492 2.42 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.227 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.97 132.64 3.09 Favored Glycine 0 N--CA 1.5 2.914 0 O-C-N 120.503 -1.586 . . . . 0.0 111.407 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' HH2' ' A' ' 78' ' ' TRP . 9.7 tp -49.85 -38.35 34.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.645 -0.915 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.62 HG22 ' HA ' ' A' ' 122' ' ' LEU . 70.1 t -59.15 -42.79 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.912 -1.117 . . . . 0.0 110.814 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -56.34 -39.08 72.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.776 -1.203 . . . . 0.0 109.218 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 49.5 t -63.34 -43.59 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.756 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 83.6 mt -66.04 -57.16 11.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 O-C-N 120.834 -1.166 . . . . 0.0 110.284 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' HG12 ' A' ' 70' ' ' VAL . 13.5 m120 -57.1 -42.85 81.54 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.268 -0.895 . . . . 0.0 110.28 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -94.44 -7.31 41.82 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.924 . . . . 0.0 111.292 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.6 mttm 58.8 58.33 3.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.299 -0.876 . . . . 0.0 110.589 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.0 mt -91.81 13.82 17.23 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.779 -1.2 . . . . 0.0 108.51 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.562 ' HH2' HD11 ' A' ' 69' ' ' LEU . 84.0 m95 -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.372 -0.83 . . . . 0.0 108.777 178.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.529 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 9.4 mp0 -50.15 -40.18 45.68 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 120.618 -1.302 . . . . 0.0 108.342 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.611 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.3 mt-10 -68.51 -40.59 80.77 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.083 -1.011 . . . . 0.0 108.302 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.35 -52.15 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 67.4 mt -53.07 -53.61 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.519 -0.738 . . . . 0.0 109.354 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 86' ' ' HIS . 26.1 mmtp -72.01 -39.59 69.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.0 109.888 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.63 -31.57 22.82 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.63 -6.83 51.57 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.439 -1.036 . . . . 0.0 109.127 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 83' ' ' LYS . 41.9 m-70 65.86 41.12 3.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.776 -0.578 . . . . 0.0 109.921 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' CD2' ' SD ' ' A' ' 49' ' ' MET . 12.0 mt -73.02 147.78 88.62 Favored Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.405 -0.81 . . . . 0.0 109.339 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.417 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.9 Cg_endo -73.29 141.47 32.17 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 C-N-CA 122.353 2.035 . . . . 0.0 112.368 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.7 p -62.25 -0.78 0.6 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.833 . . . . 0.0 109.987 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.417 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.0 p -65.79 -23.51 66.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.09 -1.006 . . . . 0.0 109.934 -178.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 80.2 mt -98.3 105.96 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 120.96 -1.088 . . . . 0.0 109.224 178.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 50.6 p -76.19 -25.66 55.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 109.054 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.1 m -96.05 34.64 1.53 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.546 -0.721 . . . . 0.0 109.259 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.29 -64.43 0.95 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.68 25.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.315 -0.865 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.88 -43.15 90.84 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.801 -1.187 . . . . 0.0 108.954 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.7 m -60.11 -40.14 88.63 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.085 -1.009 . . . . 0.0 108.426 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -70.55 -46.54 63.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.664 -0.647 . . . . 0.0 109.675 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.584 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.6 ttm180 -66.32 -52.09 50.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.905 -1.122 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.485 HG22 ' HE2' ' A' ' 104' ' ' LYS . 50.2 m -55.69 -54.09 48.53 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.133 -0.979 . . . . 0.0 110.228 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.555 ' OE1' ' CD2' ' A' ' 54' ' ' LEU . 1.0 OUTLIER -65.67 -43.68 88.57 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.975 -1.078 . . . . 0.0 112.012 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.794 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.5 t80 -55.68 -41.72 74.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.06 -1.65 . . . . 0.0 108.893 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.742 ' HG2' HD21 ' A' ' 122' ' ' LEU . 90.7 mtp -53.14 -50.72 63.96 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.514 -0.741 . . . . 0.0 110.621 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' A' ' 100' ' ' THR . 32.1 mttm -72.37 -53.95 10.82 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.031 -1.043 . . . . 0.0 112.875 -177.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.412 ' C ' HD12 ' A' ' 106' ' ' LEU . 27.9 m-85 -85.51 -52.63 5.71 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.1 mp -94.53 2.82 55.68 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.303 -1.498 . . . . 0.0 113.796 -175.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.635 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.1 t80 -62.98 -35.96 21.89 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 120.048 -1.657 . . . . 0.0 110.405 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.635 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 12.3 Cg_exo -68.53 -54.21 0.3 Allowed 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.13 1.887 . . . . 0.0 112.31 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.408 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 0.8 OUTLIER -56.97 -47.61 80.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.391 -0.818 . . . . 0.0 109.299 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 87.2 tt0 -68.89 -44.83 72.43 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.169 -0.957 . . . . 0.0 110.562 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.3 t -81.04 -45.97 15.74 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.977 -1.077 . . . . 0.0 111.244 -178.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 108' ' ' PRO . 44.1 tp10 -67.76 -51.7 45.9 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.634 -1.291 . . . . 0.0 111.518 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -73.72 -33.14 64.23 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.855 -1.153 . . . . 0.0 111.797 -178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HG2' HD21 ' A' ' 116' ' ' LEU . 34.1 tptt -114.55 -29.48 6.82 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.833 -1.167 . . . . 0.0 111.784 -177.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 111' ' ' CYS . 53.5 t30 57.29 44.79 21.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.6 -1.313 . . . . 0.0 110.288 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.444 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.8 mt -66.08 -30.06 70.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.223 -0.923 . . . . 0.0 110.581 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -154.47 -167.25 2.56 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.917 -178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' A' ' 117' ' ' SER . 82.1 p -129.01 159.49 68.47 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.515 -0.741 . . . . 0.0 109.672 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -55.52 -40.29 86.3 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.595 1.53 . . . . 0.0 112.207 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.29 -37.59 87.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.015 -1.053 . . . . 0.0 109.379 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.424 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.28 -46.06 74.75 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 103' ' ' MET . 17.6 tp -65.61 -53.28 43.85 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.404 -0.81 . . . . 0.0 109.942 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -56.86 -44.49 82.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.054 . . . . 0.0 108.907 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.05 85.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.114 -0.991 . . . . 0.0 109.155 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.439 ' CB ' HD21 ' A' ' 74' ' ' ASN . . . -68.28 -35.97 78.67 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.742 HD11 ' SD ' ' A' ' 103' ' ' MET . 29.4 mt -64.09 -49.82 79.72 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.14 -38.46 86.48 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.88 88.67 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.663 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.2 OUTLIER -94.05 -31.68 14.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.073 -1.251 . . . . 0.0 110.078 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.656 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.2 mtp180 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.853 -1.154 . . . . 0.0 109.607 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.3 mp0 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -48.51 -52.58 21.77 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.882 . . . . 0.0 109.81 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -61.22 -39.92 92.07 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.2 -0.938 . . . . 0.0 108.9 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.414 ' C ' HD11 ' A' ' 46' ' ' LEU . 14.3 mm100 -66.52 -49.18 67.38 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.365 -0.834 . . . . 0.0 110.798 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -70.96 -37.79 69.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 120.497 -1.377 . . . . 0.0 108.789 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -53.3 -39.21 63.83 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.592 -1.317 . . . . 0.0 107.761 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -58.93 -31.47 68.71 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.458 ' CD1' HD22 ' A' ' 46' ' ' LEU . 8.3 mt -72.48 -38.75 68.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.281 -0.887 . . . . 0.0 111.504 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -76.49 -33.24 58.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.433 -1.417 . . . . 0.0 110.314 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.479 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.5 mm-40 -66.98 -26.63 66.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.967 -1.083 . . . . 0.0 110.55 -178.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.697 HG21 HH12 ' A' ' 25' ' ' ARG . 32.2 mt -37.56 -38.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 O-C-N 121.798 -0.564 . . . . 0.0 110.487 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -170.72 161.62 7.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.858 -1.151 . . . . 0.0 110.323 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.7 p30 -88.99 66.52 7.88 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.539 0.685 . . . . 0.0 109.342 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -112.04 93.56 21.93 Favored Pre-proline 0 N--CA 1.489 1.503 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -47.1 -37.98 23.92 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.238 1.958 . . . . 0.0 112.004 -178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -62.77 -40.17 96.47 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.241 -0.912 . . . . 0.0 108.829 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.697 HH12 HG21 ' A' ' 19' ' ' ILE . 62.6 ttt180 -61.35 -37.08 82.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.478 -0.763 . . . . 0.0 110.454 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -60.16 -50.71 72.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.131 -0.981 . . . . 0.0 109.428 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -53.25 -38.77 63.32 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.431 -0.793 . . . . 0.0 109.677 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -62.01 -62.91 1.45 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.369 -0.832 . . . . 0.0 110.803 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 49.9 mt -55.57 -44.16 76.61 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.448 -0.782 . . . . 0.0 109.414 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.99 -48.57 81.22 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.68 -42.73 86.04 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.132 -0.98 . . . . 0.0 109.546 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.48 -53.19 60.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.29 -0.881 . . . . 0.0 110.333 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -62.3 -33.25 74.31 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 118.483 -1.287 . . . . 0.0 107.811 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -67.92 -56.59 8.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.617 -0.677 . . . . 0.0 109.663 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 49.4 t80 -60.78 -42.28 97.22 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.253 -0.904 . . . . 0.0 110.3 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.483 ' CE ' ' O ' ' A' ' 41' ' ' THR . 73.7 mmm -59.17 -40.54 85.92 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.534 -0.729 . . . . 0.0 110.912 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -60.44 -41.57 94.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.954 -1.092 . . . . 0.0 109.72 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -61.9 -47.44 84.95 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.576 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.458 HH11 ' HB3' ' A' ' 108' ' ' PRO . 13.2 mtp180 -64.38 -20.93 66.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.105 -0.997 . . . . 0.0 111.282 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.35 3.01 58.82 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.723 -1.751 . . . . 0.0 108.723 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.483 ' O ' ' CE ' ' A' ' 36' ' ' MET . 34.3 p -117.6 83.67 17.82 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.46 -1.024 . . . . 0.0 108.874 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -91.57 139.84 2.39 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 123.054 2.503 . . . . 0.0 112.146 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 78.3 mt -73.46 99.0 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.02 -1.05 . . . . 0.0 109.026 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 94.2 m-20 -64.82 -45.48 86.02 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -133.99 132.58 40.29 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' CD1' ' A' ' 16' ' ' LEU . 2.0 mt -70.97 142.66 88.02 Favored Pre-proline 0 C--N 1.299 -1.607 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.702 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -66.69 134.02 33.76 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.221 1.281 . . . . 0.0 109.095 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.15 145.71 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.884 -1.135 . . . . 0.0 110.068 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.719 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.7 mtp -141.56 118.84 11.42 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.43 43.13 1.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm 57.35 22.48 7.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.752 -0.593 . . . . 0.0 109.649 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.1 m -136.4 152.93 51.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 109.416 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.3 m -68.03 147.69 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 109.11 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.719 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.1 tp -79.45 123.17 27.28 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.412 -0.805 . . . . 0.0 110.369 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.529 ' CG ' HH22 ' A' ' 25' ' ' ARG . 12.1 m-20 -63.05 92.38 0.05 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.52 -0.738 . . . . 0.0 109.495 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.53 -27.57 57.83 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.989 -1.069 . . . . 0.0 109.718 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -78.21 -59.97 2.56 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.067 -1.021 . . . . 0.0 111.615 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -58.59 -36.33 73.83 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.743 -1.223 . . . . 0.0 109.871 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.549 HD22 HD21 ' A' ' 54' ' ' LEU . 28.7 tp -62.93 -42.86 99.94 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.442 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.2 t80 -62.83 -68.08 0.37 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 60' ' ' TYR . 61.8 t30 -42.78 -34.67 0.97 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.469 -0.769 . . . . 0.0 109.35 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.883 HD22 HH22 ' A' ' 66' ' ' ARG . 13.6 mt -71.66 -50.89 26.33 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.844 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.6 t -56.6 -43.14 77.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.494 -0.754 . . . . 0.0 110.067 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.442 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.6 mm -69.68 -34.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.69 -1.256 . . . . 0.0 108.027 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.409 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.51 -20.11 29.21 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.146 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.883 HH22 HD22 ' A' ' 62' ' ' LEU . 15.6 mmt-85 -95.13 -1.34 52.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.644 -1.285 . . . . 0.0 108.438 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.85 16.46 72.66 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.238 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.426 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 140.98 130.31 2.59 Favored Glycine 0 N--CA 1.502 3.049 0 CA-C-N 119.569 1.685 . . . . 0.0 111.618 178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.646 HD11 ' CH2' ' A' ' 78' ' ' TRP . 13.1 tp -50.95 -41.83 59.34 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.631 -0.923 . . . . 0.0 110.465 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.0 t -57.86 -43.05 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.952 -1.092 . . . . 0.0 109.25 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -55.95 -37.5 69.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.111 -0.993 . . . . 0.0 108.656 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.1 t -66.73 -43.99 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.632 -0.667 . . . . 0.0 109.975 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.15 -57.58 9.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.759 -1.213 . . . . 0.0 110.124 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.518 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 70.7 m-20 -58.02 -42.08 84.52 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.246 -0.909 . . . . 0.0 110.354 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.61 -9.02 39.44 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.279 -0.888 . . . . 0.0 110.692 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.626 ' N ' ' O ' ' A' ' 72' ' ' VAL . 25.1 mtmt 58.46 57.62 3.76 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.462 -0.773 . . . . 0.0 110.265 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.9 mt -91.37 12.63 19.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.951 -1.093 . . . . 0.0 108.594 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.646 ' CH2' HD11 ' A' ' 69' ' ' LEU . 87.6 m95 -61.11 -40.81 95.18 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt-30 -48.44 -40.93 27.9 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.898 -1.126 . . . . 0.0 108.749 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.708 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -66.61 -38.9 87.94 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.424 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.1 mt -72.9 -52.71 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.645 HD11 ' HB2' ' A' ' 95' ' ' ALA . 63.7 mt -54.15 -56.19 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.578 -0.701 . . . . 0.0 109.491 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 86' ' ' HIS . 44.9 mttp -66.68 -41.14 88.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.095 -1.003 . . . . 0.0 109.631 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.82 -30.67 29.58 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 mt -90.47 -8.78 49.59 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.428 -1.042 . . . . 0.0 109.099 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 83' ' ' LYS . 21.8 m80 63.78 42.41 6.19 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.591 -0.693 . . . . 0.0 109.868 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.72 139.41 80.52 Favored Pre-proline 0 C--N 1.304 -1.405 0 O-C-N 121.242 -0.911 . . . . 0.0 108.583 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 40.0 Cg_endo -69.93 142.95 48.56 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 121.915 1.743 . . . . 0.0 112.213 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.9 t -55.94 0.61 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.259 -0.901 . . . . 0.0 109.814 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 93.2 p -66.84 -26.0 66.7 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.222 -0.924 . . . . 0.0 110.193 -178.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.541 HD11 ' H ' ' A' ' 50' ' ' ALA . 87.4 mt -101.47 107.41 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 120.92 -1.112 . . . . 0.0 109.522 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.9 p -79.05 -25.32 43.17 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.251 -0.905 . . . . 0.0 109.027 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -95.33 35.02 1.35 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.561 -0.712 . . . . 0.0 109.445 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.61 -65.2 0.73 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.138 -0.976 . . . . 0.0 108.631 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.645 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.17 -52.98 18.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.302 -0.874 . . . . 0.0 109.21 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.412 ' O ' ' OG1' ' A' ' 100' ' ' THR . 9.0 tp -58.95 -43.97 91.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.992 -1.067 . . . . 0.0 109.182 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 m -61.71 -39.96 93.36 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.953 -1.092 . . . . 0.0 108.692 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.503 HD22 HD13 ' A' ' 59' ' ' LEU . 12.0 mt -67.77 -44.22 77.96 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.562 -0.711 . . . . 0.0 110.068 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.814 ' NH1' HD21 ' A' ' 129' ' ' ASN . 28.6 ttm180 -68.81 -49.96 54.18 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.287 -0.883 . . . . 0.0 111.178 -179.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -52.94 -53.18 53.27 Favored 'General case' 0 C--N 1.294 -1.837 0 C-N-CA 118.717 -1.193 . . . . 0.0 109.115 -178.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -63.83 -42.41 97.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.153 -0.967 . . . . 0.0 111.745 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.844 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.4 t80 -58.96 -43.91 91.38 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.207 -1.558 . . . . 0.0 109.395 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.75 ' HG2' HD21 ' A' ' 122' ' ' LEU . 89.7 mtp -51.52 -56.84 11.16 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.505 -0.747 . . . . 0.0 111.372 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -72.78 -52.67 14.06 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.767 -1.208 . . . . 0.0 112.701 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -85.14 -50.37 7.47 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -174.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.58 -5.02 40.13 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.126 -1.609 . . . . 0.0 114.109 -175.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.9 t80 -60.12 -38.56 60.51 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 119.687 -1.883 . . . . 0.0 109.62 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.7 Cg_exo -65.64 -54.79 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.421 2.081 . . . . 0.0 112.6 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.78 -39.55 81.4 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.367 -0.833 . . . . 0.0 109.137 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.401 ' OE1' ' N ' ' A' ' 111' ' ' CYS . 0.4 OUTLIER -73.12 -51.16 18.99 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.455 -0.778 . . . . 0.0 110.287 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -71.42 -43.02 67.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.403 -0.81 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.93 -51.09 59.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.863 -1.148 . . . . 0.0 111.033 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -74.71 -27.88 60.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.146 -0.971 . . . . 0.0 111.691 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG2' HD21 ' A' ' 116' ' ' LEU . 30.7 tptt -123.26 -30.31 3.72 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.911 -1.118 . . . . 0.0 111.298 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 111' ' ' CYS . 40.0 t30 57.41 45.95 19.01 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.819 -1.176 . . . . 0.0 110.12 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 114' ' ' LYS . 60.1 mt -67.03 -31.72 72.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.174 -0.954 . . . . 0.0 110.894 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.2 t -154.39 -166.97 2.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.94 -1.1 . . . . 0.0 111.316 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.508 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.0 p -127.79 158.46 70.27 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.646 -0.659 . . . . 0.0 109.98 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -55.87 -41.32 78.43 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 121.651 1.567 . . . . 0.0 112.256 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.31 90.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.849 -1.157 . . . . 0.0 109.668 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.07 -42.4 89.47 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 103' ' ' MET . 27.9 tp -68.49 -52.71 29.31 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.71 -0.619 . . . . 0.0 110.173 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -58.26 -46.41 86.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.382 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.48 -42.23 98.47 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -0.854 . . . . 0.0 110.162 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.518 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -67.72 -33.62 75.24 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.599 HD11 ' SD ' ' A' ' 103' ' ' MET . 11.1 mt -65.9 -46.49 88.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.409 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 61.7 t0 -64.73 -37.76 88.68 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.982 -1.074 . . . . 0.0 109.391 179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.37 -29.86 75.61 Favored Glycine 0 N--CA 1.492 2.397 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.033 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.814 HD21 ' NH1' ' A' ' 99' ' ' ARG . 33.9 p-10 -92.0 -31.43 15.6 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.863 -1.374 . . . . 0.0 111.424 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.651 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 76.3 mtm180 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 120.516 -1.365 . . . . 0.0 110.237 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.771 ' O ' HG12 ' A' ' 13' ' ' VAL . 36.0 mm-40 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.759 0.314 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -49.2 -46.67 45.96 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.724 -1.235 . . . . 0.0 109.252 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -61.18 -40.73 95.01 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.43 -0.794 . . . . 0.0 109.532 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.49 -53.17 25.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.323 -0.861 . . . . 0.0 111.404 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -68.87 -36.14 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 120.803 -1.186 . . . . 0.0 109.279 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -58.74 -38.44 78.39 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.301 -1.499 . . . . 0.0 108.03 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -59.41 -31.71 69.51 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.218 -0.926 . . . . 0.0 108.655 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.494 ' HB3' HD13 ' A' ' 29' ' ' LEU . 7.0 mt -67.09 -40.37 86.96 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.31 -0.869 . . . . 0.0 111.166 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 83.3 m-85 -74.9 -35.59 62.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.487 -1.383 . . . . 0.0 109.595 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.483 ' O ' ' C ' ' A' ' 19' ' ' ILE . 99.1 mt-10 -64.43 -29.9 70.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.627 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.508 HD13 ' NH2' ' A' ' 25' ' ' ARG . 24.2 mt -37.4 -41.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.607 -0.683 . . . . 0.0 110.702 -178.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -171.56 163.33 6.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.716 -1.24 . . . . 0.0 110.891 -178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -90.3 69.91 7.08 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.462 0.649 . . . . 0.0 109.596 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.01 94.93 27.24 Favored Pre-proline 0 N--CA 1.489 1.523 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -46.69 -44.44 21.7 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 122.166 1.911 . . . . 0.0 112.024 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -63.43 -40.37 96.97 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.179 -0.95 . . . . 0.0 108.615 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.508 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.3 ttt180 -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.433 -0.792 . . . . 0.0 109.803 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.0 -49.04 79.24 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.16 -0.963 . . . . 0.0 108.686 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -53.61 -38.25 63.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.463 -0.773 . . . . 0.0 109.385 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -64.03 -59.84 3.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.465 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 16' ' ' LEU . 28.4 mt -56.45 -45.54 80.77 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.124 -0.985 . . . . 0.0 108.657 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.457 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 40.8 m-20 -60.15 -47.95 83.79 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.567 -0.853 . . . . 0.0 108.843 179.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -66.41 -43.49 85.6 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.484 -0.76 . . . . 0.0 109.889 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 tp -58.64 -49.75 76.37 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.211 -0.931 . . . . 0.0 110.306 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.6 ' CE1' HD12 ' A' ' 43' ' ' ILE . 49.4 m-85 -59.92 -36.93 78.07 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.953 -1.499 . . . . 0.0 107.792 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.4 m -69.71 -49.86 49.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.363 -0.836 . . . . 0.0 109.813 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.411 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 72.9 t80 -59.12 -46.21 88.92 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.302 -0.874 . . . . 0.0 111.123 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.401 ' SD ' HD11 ' A' ' 43' ' ' ILE . 95.4 mtp -57.36 -34.76 69.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.75 -178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -55.6 -34.99 65.35 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.647 -1.283 . . . . 0.0 108.784 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -74.75 -34.71 62.57 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 25.3 mmm180 -66.25 -30.97 71.51 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.028 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.23 0.17 63.5 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.0 p -115.25 85.18 12.39 Favored Pre-proline 0 N--CA 1.486 1.35 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.94 140.56 14.42 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 121.94 1.76 . . . . 0.0 110.513 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.6 HD12 ' CE1' ' A' ' 33' ' ' PHE . 29.8 mt -70.47 92.03 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 120.936 -1.103 . . . . 0.0 110.591 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 88.1 m-20 -58.9 -30.1 67.54 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -167.17 140.08 3.49 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.573 HD23 HG21 ' A' ' 43' ' ' ILE . 17.1 mt -70.69 144.13 90.65 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.857 -1.152 . . . . 0.0 110.237 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.41 134.22 18.6 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.516 1.477 . . . . 0.0 108.369 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.45 HG23 ' N ' ' A' ' 52' ' ' SER . 56.6 mt -103.18 142.51 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 110.842 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.568 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.2 mtp -136.24 123.95 22.44 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.04 39.97 4.2 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt 57.57 22.39 8.12 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.273 0.558 . . . . 0.0 110.119 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.45 ' N ' HG23 ' A' ' 48' ' ' ILE . 49.3 m -134.38 151.16 51.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.257 -0.902 . . . . 0.0 109.22 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.56 143.46 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 120.774 -1.204 . . . . 0.0 108.708 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 HD22 ' A' ' 59' ' ' LEU . 64.3 tp -74.58 123.02 24.04 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.258 -0.901 . . . . 0.0 109.468 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -56.41 105.28 0.19 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.72 -30.57 71.58 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -80.21 -64.96 1.07 Allowed 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.238 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -52.95 -39.82 63.2 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 120.623 -1.298 . . . . 0.0 108.755 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.546 HD22 HD21 ' A' ' 54' ' ' LEU . 24.1 tp -55.8 -48.7 74.92 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.2 t80 -62.75 -66.8 0.49 Allowed 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.442 0.639 . . . . 0.0 109.913 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -43.06 -40.51 3.16 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.459 -0.776 . . . . 0.0 110.905 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.432 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -72.66 -47.07 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 117.897 -1.521 . . . . 0.0 107.836 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.785 HG21 ' CE2' ' A' ' 102' ' ' TYR . 26.6 t -55.34 -42.65 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.954 . . . . 0.0 109.987 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.409 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.0 mm -68.41 -35.67 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 120.504 -1.372 . . . . 0.0 107.715 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.85 -17.39 23.42 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.961 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.673 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.9 mmt-85 -96.99 5.3 50.7 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.524 -1.36 . . . . 0.0 108.986 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.6 11.24 82.14 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.646 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.99 134.56 3.29 Favored Glycine 0 N--CA 1.5 2.95 0 CA-C-N 119.252 1.526 . . . . 0.0 111.413 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 tp -48.55 -42.67 34.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.708 -0.877 . . . . 0.0 110.832 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.507 HG22 ' HA ' ' A' ' 122' ' ' LEU . 95.1 t -58.11 -40.64 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.0 110.005 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -58.59 -40.36 82.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.002 . . . . 0.0 110.034 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.581 ' O ' ' N ' ' A' ' 76' ' ' LYS . 40.3 t -64.55 -47.01 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.264 -0.897 . . . . 0.0 110.639 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.08 -56.68 16.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.814 -1.179 . . . . 0.0 109.894 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.653 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 86.7 m-20 -59.56 -43.69 93.49 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.284 -0.885 . . . . 0.0 111.568 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -94.05 -4.46 49.41 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.909 -1.119 . . . . 0.0 110.685 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.581 ' N ' ' O ' ' A' ' 72' ' ' VAL . 51.0 mttm 59.24 56.74 3.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.595 -0.691 . . . . 0.0 111.135 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.6 mt -90.51 13.84 14.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.561 -1.256 . . . . 0.0 107.941 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' ILE . 96.9 m95 -63.49 -41.41 98.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.43 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.9 mt-30 -47.86 -39.92 19.98 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 120.809 -1.182 . . . . 0.0 108.011 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.673 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.3 mt-10 -67.33 -38.54 85.07 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.463 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.0 mt -74.78 -51.91 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.37 -0.831 . . . . 0.0 108.987 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.654 HD11 ' HB2' ' A' ' 95' ' ' ALA . 60.8 mt -50.58 -51.47 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -74.65 -37.4 62.76 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.592 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.44 -32.92 46.18 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 83.2 mt -91.17 -7.31 51.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.38 -1.071 . . . . 0.0 109.255 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.0 m80 65.03 40.59 5.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.777 -0.577 . . . . 0.0 110.106 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.3 mt -72.5 136.83 80.82 Favored Pre-proline 0 N--CA 1.488 1.467 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 35.7 Cg_endo -68.54 144.23 60.06 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.891 1.727 . . . . 0.0 112.48 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.0 p -58.19 0.66 0.06 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.265 -0.897 . . . . 0.0 109.654 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 18.0 m -64.07 -35.31 80.32 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.138 -0.976 . . . . 0.0 109.301 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.594 HD11 ' H ' ' A' ' 50' ' ' ALA . 89.5 mt -90.07 97.41 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.939 -1.101 . . . . 0.0 108.54 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 68.7 p -66.62 -27.86 68.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.873 . . . . 0.0 109.813 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.8 m -102.46 47.77 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.169 -0.957 . . . . 0.0 109.512 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.71 -59.43 3.58 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.169 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.654 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.83 -51.14 23.91 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.287 -0.883 . . . . 0.0 109.879 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.474 HD12 HH21 ' A' ' 99' ' ' ARG . 5.6 tp -58.4 -44.29 88.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.748 -1.22 . . . . 0.0 109.039 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.3 m -60.81 -40.46 92.78 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.152 -0.968 . . . . 0.0 108.694 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.433 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 10.5 mt -71.18 -44.28 65.76 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.483 -0.761 . . . . 0.0 109.941 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.798 HH12 HD21 ' A' ' 129' ' ' ASN . 40.9 ttp180 -66.5 -53.1 38.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.24 -0.912 . . . . 0.0 110.947 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -56.59 -52.28 65.42 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.473 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -62.46 -40.08 95.46 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.046 -1.034 . . . . 0.0 110.978 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.785 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.7 t80 -57.08 -41.0 78.02 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.382 -1.449 . . . . 0.0 109.2 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.571 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -54.65 -54.72 37.89 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.463 -0.773 . . . . 0.0 111.396 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.8 mttt -72.65 -50.54 24.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.564 -1.335 . . . . 0.0 113.098 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.463 ' C ' HD12 ' A' ' 106' ' ' LEU . 34.3 m-85 -84.8 -52.86 5.74 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -174.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.0 mp -100.44 12.65 36.76 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.222 -1.549 . . . . 0.0 114.391 -175.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.525 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 62.7 t80 -67.37 -38.65 16.6 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 119.796 -1.815 . . . . 0.0 111.815 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.1 Cg_endo -78.05 -40.09 0.41 Allowed 'Trans proline' 0 N--CA 1.49 1.302 0 C-N-CA 121.475 1.45 . . . . 0.0 112.834 -178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.14 -42.97 87.04 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -68.96 -51.89 34.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.634 -0.666 . . . . 0.0 110.256 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.526 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.7 m -71.45 -43.69 66.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.376 -0.827 . . . . 0.0 110.932 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 46.4 tp10 -66.72 -50.26 63.38 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.086 -1.009 . . . . 0.0 111.223 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -75.83 -26.54 57.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.021 -1.049 . . . . 0.0 111.402 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.431 ' HG2' HD21 ' A' ' 116' ' ' LEU . 29.1 tptt -125.33 -30.46 3.14 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.043 -1.036 . . . . 0.0 111.82 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 111' ' ' CYS . 28.9 t-20 59.66 45.11 13.46 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.737 -1.227 . . . . 0.0 110.206 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.431 HD21 ' HG2' ' A' ' 114' ' ' LYS . 84.6 mt -69.57 -32.15 70.76 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.136 -0.978 . . . . 0.0 111.288 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 118' ' ' THR . 32.0 t -153.12 -167.04 2.6 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.515 -1.274 . . . . 0.0 112.064 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.531 ' N ' ' OG ' ' A' ' 117' ' ' SER . 40.1 p -129.81 155.26 80.75 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 121.835 -0.541 . . . . 0.0 109.695 -178.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.01 -40.63 80.4 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.112 1.875 . . . . 0.0 112.122 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.79 88.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.821 -1.174 . . . . 0.0 109.254 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.67 -45.25 79.53 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.571 HD21 ' HG3' ' A' ' 103' ' ' MET . 34.6 tp -65.97 -51.77 55.5 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -57.26 -47.34 81.67 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.234 -0.916 . . . . 0.0 109.533 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.84 90.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.402 -0.811 . . . . 0.0 109.873 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.653 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.46 -36.09 78.51 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.055 0.931 . . . . 0.0 108.547 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.427 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 34.1 mt -65.59 -48.33 83.05 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.031 0 CA-C-O 121.521 0.677 . . . . 0.0 109.191 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -64.19 -37.22 86.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.406 -0.809 . . . . 0.0 109.095 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.6 -36.01 92.62 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.798 HD21 HH12 ' A' ' 99' ' ' ARG . 0.1 OUTLIER -93.87 -36.0 12.43 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.115 -1.226 . . . . 0.0 110.63 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.662 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 57.4 mtp180 . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.677 -1.264 . . . . 0.0 109.778 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -53.55 -48.52 69.03 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.308 -0.87 . . . . 0.0 109.471 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -62.45 -38.97 91.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.101 -0.999 . . . . 0.0 109.204 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.31 -48.74 72.04 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.77 . . . . 0.0 110.386 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -74.06 -34.67 39.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 O-C-N 120.761 -1.212 . . . . 0.0 108.218 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -54.65 -40.6 69.18 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.49 -31.08 69.03 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.7 mt -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.829 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.7 m-85 -81.54 -32.24 32.36 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.536 -1.352 . . . . 0.0 110.458 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.486 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.6 mt-10 -67.73 -31.02 70.67 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.827 -1.171 . . . . 0.0 110.432 -178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 16' ' ' LEU . 14.6 mt -35.28 -39.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.784 -0.572 . . . . 0.0 110.556 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.573 ' ND2' ' OD1' ' A' ' 22' ' ' ASP . 41.3 p-10 -173.72 167.06 4.5 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.97 -1.081 . . . . 0.0 110.034 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -94.22 64.75 3.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.624 -0.673 . . . . 0.0 109.821 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.573 ' OD1' ' ND2' ' A' ' 20' ' ' ASN . 1.7 m-20 -96.33 141.4 23.06 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.061 -1.024 . . . . 0.0 108.811 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.48 -61.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.14 1.893 . . . . 0.0 112.329 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -60.81 -34.09 74.01 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.858 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.718 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -55.53 -44.95 77.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.98 -1.075 . . . . 0.0 109.954 -179.109 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -61.89 -54.71 38.28 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.04 -1.037 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.05 -37.91 61.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 108.872 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -61.37 -62.81 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.396 -0.815 . . . . 0.0 109.392 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.503 HD11 ' NH1' ' A' ' 25' ' ' ARG . 69.2 mt -54.17 -47.74 71.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.538 -0.726 . . . . 0.0 109.684 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.31 -49.26 77.72 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.197 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -66.63 -42.3 86.99 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.998 -1.064 . . . . 0.0 109.635 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.67 -52.53 65.06 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.271 -0.893 . . . . 0.0 110.356 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -60.54 -34.34 73.99 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.984 -1.486 . . . . 0.0 107.74 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.3 m -69.29 -53.43 19.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.372 -0.83 . . . . 0.0 109.51 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.409 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 72.2 t80 -59.51 -40.13 86.07 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.568 -0.707 . . . . 0.0 110.57 -179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 75.3 mmm -58.96 -37.8 77.61 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.333 -0.854 . . . . 0.0 110.83 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.93 -39.41 94.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.909 -1.119 . . . . 0.0 110.286 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -69.47 -30.58 68.5 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.91 -1.119 . . . . 0.0 108.358 179.417 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.431 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -67.27 -30.58 70.49 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.76 -2.21 58.47 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 107.389 -2.284 . . . . 0.0 107.389 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 75.2 p -118.86 84.41 25.6 Favored Pre-proline 0 N--CA 1.491 1.597 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -83.02 137.15 8.4 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.561 2.174 . . . . 0.0 111.082 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.9 mt -73.98 97.73 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.038 -1.038 . . . . 0.0 109.94 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.41 -43.68 89.81 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.578 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.33 133.4 38.78 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.949 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.422 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.4 mt -70.33 146.64 94.6 Favored Pre-proline 0 C--N 1.298 -1.65 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.528 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -67.08 127.29 16.54 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 121.209 1.273 . . . . 0.0 109.186 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.0 mt -96.11 143.67 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.848 -1.158 . . . . 0.0 109.763 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.841 ' SD ' HG21 ' A' ' 97' ' ' THR . 57.3 mmm -140.54 123.35 16.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.669 0.747 . . . . 0.0 108.991 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.4 41.42 3.27 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.1 mttt 57.93 23.32 9.7 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.45 0.643 . . . . 0.0 109.89 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 89.7 p -136.98 155.62 49.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 108.936 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.28 148.42 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.972 -1.08 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HG3' ' A' ' 49' ' ' MET . 34.5 tp -81.66 122.91 28.22 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.685 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -65.17 89.43 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 0.0 109.07 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.5 mt -56.06 -23.54 34.13 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 120.786 -1.196 . . . . 0.0 109.168 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -78.43 -56.21 4.62 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.36 -0.838 . . . . 0.0 111.437 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.81 -39.33 91.35 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.815 -1.178 . . . . 0.0 110.132 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.7 -44.28 93.75 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.083 -1.011 . . . . 0.0 108.286 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HD1' ' HH ' ' A' ' 102' ' ' TYR . 52.9 t80 -56.21 -67.17 0.32 Allowed 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -43.17 -39.16 2.75 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 111.138 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.579 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 7.8 mt -70.66 -44.36 67.25 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 118.057 -1.457 . . . . 0.0 107.562 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.82 HG21 ' CE2' ' A' ' 102' ' ' TYR . 48.6 t -59.44 -45.05 93.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.264 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 64' ' ' ILE . 6.0 mm -68.22 -34.8 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.637 -1.289 . . . . 0.0 108.367 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.58 -26.95 35.52 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.774 -0.578 . . . . 0.0 110.358 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.9 mpt_? -90.74 -0.55 57.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.441 -1.412 . . . . 0.0 108.914 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.54 19.74 61.44 Favored Glycine 0 N--CA 1.489 2.221 0 C-N-CA 120.386 -0.912 . . . . 0.0 111.808 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.412 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 138.44 131.9 2.93 Favored Glycine 0 N--CA 1.499 2.838 0 O-C-N 120.672 -1.487 . . . . 0.0 111.418 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.553 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.1 tp -49.65 -39.54 36.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.617 -0.931 . . . . 0.0 109.914 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 122' ' ' LEU . 83.4 t -58.29 -43.22 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.212 -0.93 . . . . 0.0 109.907 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -54.99 -39.37 68.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.725 -1.234 . . . . 0.0 109.045 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.599 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.0 t -63.37 -42.11 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.49 -0.756 . . . . 0.0 109.845 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 HH11 ' A' ' 99' ' ' ARG . 72.7 mt -66.61 -58.52 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.661 -1.274 . . . . 0.0 110.454 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -56.64 -42.47 78.97 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.36 -9.46 38.73 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.22 -0.925 . . . . 0.0 110.826 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 72' ' ' VAL . 40.3 mttp 58.17 60.81 2.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.211 -0.93 . . . . 0.0 110.292 -178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 15.7 mt -93.23 16.24 13.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.017 -1.052 . . . . 0.0 108.497 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.553 ' HH2' HD11 ' A' ' 69' ' ' LEU . 82.3 m95 -64.78 -39.07 93.01 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.424 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.1 mm-40 -49.54 -38.28 30.28 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 118.425 -1.31 . . . . 0.0 108.093 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -69.26 -40.57 77.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 mt -71.75 -53.33 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.431 -0.793 . . . . 0.0 109.062 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.1 mt -51.48 -53.7 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 109.19 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -68.94 -39.15 79.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.223 -0.923 . . . . 0.0 110.201 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.7 -32.63 47.5 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.458 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 1.1 mm? -89.18 -7.95 54.61 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.385 -1.068 . . . . 0.0 108.7 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 63.96 42.34 5.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.837 -0.54 . . . . 0.0 110.331 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 142.16 83.62 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.201 -0.937 . . . . 0.0 108.934 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.582 ' C ' ' H ' ' A' ' 90' ' ' SER . 36.5 Cg_endo -69.86 143.2 49.59 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 C-N-CA 122.063 1.842 . . . . 0.0 112.456 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.7 p -55.61 -1.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.414 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.582 ' H ' ' C ' ' A' ' 88' ' ' PRO . 23.3 m -64.43 -34.19 77.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 110.154 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.552 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.0 mt -90.99 97.5 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 120.738 -1.226 . . . . 0.0 109.243 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 69.1 p -70.45 -21.92 62.75 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.284 -0.885 . . . . 0.0 109.194 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 57.9 m -104.25 43.37 1.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.467 -0.771 . . . . 0.0 109.159 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.39 -61.19 2.26 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.331 -0.856 . . . . 0.0 109.319 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.4 -50.47 30.8 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 109.807 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.7 tp -58.02 -46.06 85.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.765 -1.209 . . . . 0.0 109.116 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.841 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.2 m -58.92 -41.08 86.44 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.047 -1.033 . . . . 0.0 108.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.19 -44.46 68.66 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.802 . . . . 0.0 109.507 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.469 ' HG3' HH11 ' A' ' 99' ' ' ARG . 6.7 ttm-85 -65.81 -55.04 19.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.981 -1.074 . . . . 0.0 111.017 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.4 m -57.22 -52.9 63.46 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.436 -0.79 . . . . 0.0 111.003 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.66 -43.79 97.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.071 -1.018 . . . . 0.0 111.715 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.82 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.1 t80 -57.69 -39.65 77.66 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.356 -1.465 . . . . 0.0 109.595 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -54.46 -54.72 37.12 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.28 -0.888 . . . . 0.0 111.65 -178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -72.87 -52.88 13.03 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.477 -1.389 . . . . 0.0 113.198 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -84.68 -50.33 7.73 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.571 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.2 mp -97.2 6.23 48.78 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.235 -1.541 . . . . 0.0 113.863 -176.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.596 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 68.8 t80 -67.74 -37.01 10.85 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 119.955 -1.716 . . . . 0.0 111.684 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 60.6 Cg_endo -78.75 -40.98 0.26 Allowed 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 121.354 1.369 . . . . 0.0 112.096 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.54 -42.97 89.07 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -70.86 -46.04 63.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.599 -0.688 . . . . 0.0 110.072 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.1 t -77.03 -45.81 25.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.337 -0.852 . . . . 0.0 110.611 -178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.5 tp10 -66.22 -47.13 74.82 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.099 -1.001 . . . . 0.0 110.856 -178.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -76.61 -33.63 58.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.095 -1.003 . . . . 0.0 111.417 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.492 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.6 tptp -119.6 -27.43 5.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 111.783 -177.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 111' ' ' CYS . 24.1 t-20 55.76 45.34 24.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.78 -1.2 . . . . 0.0 110.389 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 114' ' ' LYS . 73.1 mt -67.24 -31.34 71.63 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.176 -0.952 . . . . 0.0 110.966 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.5 t -154.65 -167.0 2.47 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 118.746 -1.182 . . . . 0.0 111.576 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.522 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.6 p -122.06 152.67 60.34 Favored Pre-proline 0 N--CA 1.497 1.907 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.061 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.596 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 10.9 Cg_endo -55.85 -38.76 94.09 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.883 1.722 . . . . 0.0 112.092 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.95 -37.71 88.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.98 -1.075 . . . . 0.0 109.539 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.431 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.7 mt-10 -66.96 -43.42 83.15 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 103' ' ' MET . 15.6 tp -64.31 -52.92 56.11 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.536 -0.728 . . . . 0.0 109.657 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -58.62 -47.25 84.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.331 -0.855 . . . . 0.0 109.794 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.12 -38.68 87.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 110.033 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.84 -34.04 76.92 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.543 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -68.42 -45.61 81.93 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 N-CA-C 108.102 -1.074 . . . . 0.0 108.102 177.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.477 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 62.5 t0 -58.94 -40.05 83.47 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.046 -1.034 . . . . 0.0 108.799 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.14 -26.83 73.73 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 17.5 p-10 -89.49 -31.82 17.49 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.766 -1.432 . . . . 0.0 110.595 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.652 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 85.5 mtm180 . . . . . 0 N--CA 1.492 1.636 0 O-C-N 120.662 -1.273 . . . . 0.0 110.083 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.582 ' O ' HG13 ' A' ' 13' ' ' VAL . 33.7 mt-30 . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 120.631 0.253 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -54.24 -49.54 69.24 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.694 -1.254 . . . . 0.0 110.052 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -62.02 -42.32 99.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.068 -1.02 . . . . 0.0 109.453 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.04 -47.27 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.261 -0.899 . . . . 0.0 110.891 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.582 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -72.67 -36.7 53.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 120.58 -1.325 . . . . 0.0 108.8 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -53.49 -40.44 65.36 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.45 -31.3 69.18 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.466 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -72.91 -36.33 67.24 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.462 -0.773 . . . . 0.0 111.633 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.481 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -79.05 -33.38 44.76 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.318 -1.489 . . . . 0.0 110.769 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.5 mm-40 -67.18 -26.35 66.6 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.888 -1.132 . . . . 0.0 110.528 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.474 ' C ' ' O ' ' A' ' 18' ' ' GLU . 28.7 mt -37.79 -39.55 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.617 -0.677 . . . . 0.0 110.694 -178.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -171.65 163.76 6.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.752 -1.218 . . . . 0.0 110.321 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -90.0 65.18 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.696 -0.627 . . . . 0.0 110.213 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -112.44 95.87 33.52 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.464 -0.773 . . . . 0.0 108.976 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.61 -40.16 30.2 Favored 'Trans proline' 0 N--CA 1.493 1.441 0 C-N-CA 122.358 2.038 . . . . 0.0 112.272 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -60.91 -41.1 95.46 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.02 -1.05 . . . . 0.0 108.592 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.706 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -59.79 -39.02 83.55 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.485 -0.76 . . . . 0.0 109.416 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.593 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 57.7 tttm -59.94 -50.58 73.2 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.16 -39.17 63.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -63.42 -61.86 2.06 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.486 -0.759 . . . . 0.0 109.539 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.566 HD21 HH12 ' A' ' 25' ' ' ARG . 74.7 mt -56.14 -46.73 79.13 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.345 -0.847 . . . . 0.0 109.067 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.593 ' OD2' ' NZ ' ' A' ' 26' ' ' LYS . 70.3 m-20 -62.29 -52.14 64.91 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.702 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.81 -40.87 92.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.244 -0.91 . . . . 0.0 109.188 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -57.23 -55.69 31.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.334 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.9 m-85 -60.63 -34.05 73.69 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.08 -1.448 . . . . 0.0 107.979 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -69.96 -52.95 20.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.514 -0.741 . . . . 0.0 110.614 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -60.19 -43.57 95.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 111.908 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 98.1 mtp -57.86 -34.36 69.67 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.095 -1.003 . . . . 0.0 111.123 -178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -54.12 -40.18 67.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.622 -1.299 . . . . 0.0 108.169 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -67.21 -37.53 83.78 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.469 -0.769 . . . . 0.0 109.358 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.418 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.6 mmm180 -63.5 -31.66 72.88 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.729 -0.607 . . . . 0.0 109.602 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.41 -2.96 61.2 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 108.238 -1.945 . . . . 0.0 108.238 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 39.6 p -118.99 85.18 28.41 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -83.49 144.6 11.48 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.58 2.187 . . . . 0.0 111.666 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.454 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 8.9 mt -77.13 94.07 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.109 -0.995 . . . . 0.0 109.264 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -61.0 -35.33 76.57 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.617 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -148.44 136.04 20.61 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.466 HD13 ' CD1' ' A' ' 16' ' ' LEU . 1.7 mt -71.45 145.49 90.43 Favored Pre-proline 0 C--N 1.297 -1.692 0 O-C-N 120.987 -1.071 . . . . 0.0 109.003 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -67.39 133.69 31.05 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 N-CA-C 108.982 -1.199 . . . . 0.0 108.982 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.7 mt -101.59 145.51 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.887 -1.133 . . . . 0.0 109.945 -178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.739 ' SD ' HD13 ' A' ' 54' ' ' LEU . 81.3 mtp -144.67 118.74 9.42 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 73.15 37.98 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mttt 57.79 25.15 11.59 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.639 0.733 . . . . 0.0 109.29 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 93.3 p -136.85 154.87 50.39 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.3 m -68.04 145.32 13.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.176 -0.953 . . . . 0.0 109.076 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.739 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.8 tp -77.92 123.61 27.0 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.306 -0.872 . . . . 0.0 109.512 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -62.89 88.51 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.8 mt -53.96 -25.43 20.65 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.87 -1.144 . . . . 0.0 108.957 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -78.86 -52.69 7.97 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.342 -0.849 . . . . 0.0 111.984 -178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -64.38 -37.34 87.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.556 -1.34 . . . . 0.0 110.165 -178.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 98' ' ' LEU . 56.4 tp -58.79 -44.03 90.62 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.969 ' CE1' HD11 ' A' ' 64' ' ' ILE . 56.6 t80 -56.36 -73.66 0.06 Allowed 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -39.36 -41.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.257 -0.902 . . . . 0.0 111.782 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mt -71.46 -44.48 64.71 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 117.943 -1.503 . . . . 0.0 107.945 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.682 HG21 ' CE2' ' A' ' 102' ' ' TYR . 19.1 t -59.34 -46.69 92.3 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.164 179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.969 HD11 ' CE1' ' A' ' 60' ' ' TYR . 5.5 mm -68.99 -35.59 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.769 -1.207 . . . . 0.0 107.843 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.415 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.57 -23.0 9.5 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.628 -178.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.521 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.4 mpt_? -92.26 -1.94 56.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.648 -1.283 . . . . 0.0 108.782 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.48 19.47 64.07 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.166 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.07 127.54 2.23 Favored Glycine 0 N--CA 1.5 2.929 0 CA-C-N 119.596 1.698 . . . . 0.0 111.846 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.567 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.7 tp -46.91 -39.39 12.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.586 -0.95 . . . . 0.0 109.526 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.6 t -59.43 -42.1 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.223 -0.923 . . . . 0.0 109.656 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -55.01 -42.7 72.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.036 -1.04 . . . . 0.0 109.47 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 76' ' ' LYS . 22.5 t -63.28 -43.42 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.468 -0.77 . . . . 0.0 110.201 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -64.95 -56.72 14.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 O-C-N 120.813 -1.179 . . . . 0.0 110.45 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -57.38 -41.94 81.18 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -93.6 -9.91 36.45 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.029 -1.044 . . . . 0.0 110.436 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 72' ' ' VAL . 38.6 mtmt 58.73 59.96 2.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.441 -0.787 . . . . 0.0 109.772 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.3 mt -93.01 14.38 17.89 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.189 -0.945 . . . . 0.0 108.663 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.8 m95 -62.27 -39.38 92.73 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 78' ' ' TRP . 87.6 mm-40 -49.08 -39.29 27.38 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.722 -1.236 . . . . 0.0 108.386 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HB3' HH21 ' A' ' 66' ' ' ARG . 77.1 mm-40 -69.83 -39.54 76.4 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt -71.08 -54.87 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.295 -0.878 . . . . 0.0 108.881 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.622 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.1 mt -51.24 -55.61 7.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -68.41 -36.8 79.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.063 -1.023 . . . . 0.0 109.206 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.45 -34.99 49.95 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.6 mt -88.27 -7.25 57.06 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.351 -1.088 . . . . 0.0 108.667 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 66.54 40.58 3.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.236 0.541 . . . . 0.0 110.004 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.43 142.87 81.92 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.939 . . . . 0.0 108.545 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.563 ' C ' ' H ' ' A' ' 90' ' ' SER . 42.3 Cg_endo -70.34 144.28 50.46 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.142 1.895 . . . . 0.0 112.301 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 p -57.57 -0.35 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.205 -0.935 . . . . 0.0 109.486 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 88' ' ' PRO . 13.8 m -65.01 -30.74 71.74 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.354 -0.841 . . . . 0.0 109.844 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.429 HD11 ' N ' ' A' ' 50' ' ' ALA . 70.8 mt -93.81 97.54 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 120.656 -1.278 . . . . 0.0 109.274 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.6 p -71.87 -25.0 61.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.938 . . . . 0.0 109.345 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 m -101.88 41.77 1.19 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.64 -59.58 3.02 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.349 -0.845 . . . . 0.0 109.252 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.622 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.22 -52.6 15.44 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.152 -0.967 . . . . 0.0 109.038 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.46 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.0 tp -58.63 -44.63 90.07 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.06 -1.025 . . . . 0.0 109.214 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.3 m -60.2 -40.27 89.47 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.116 -0.99 . . . . 0.0 108.903 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 59' ' ' LEU . 9.6 mt -68.77 -46.08 69.69 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.614 -0.679 . . . . 0.0 109.786 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.671 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 37.4 ttm180 -64.94 -51.42 61.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.333 -0.854 . . . . 0.0 110.884 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -54.69 -54.75 37.69 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.671 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -62.59 -42.0 99.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 0.0 111.559 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.682 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.2 t80 -58.02 -43.33 86.64 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 120.207 -1.558 . . . . 0.0 109.256 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.705 ' HG2' HD21 ' A' ' 122' ' ' LEU . 85.3 mtp -53.36 -57.43 10.62 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.734 -0.604 . . . . 0.0 112.325 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -72.82 -51.26 19.6 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.671 -1.268 . . . . 0.0 112.79 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.4 ' C ' HD12 ' A' ' 106' ' ' LEU . 71.2 m-85 -84.27 -47.41 10.8 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.545 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.5 mp -98.86 -1.43 40.18 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.33 -1.481 . . . . 0.0 114.035 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.643 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 81.1 t80 -63.12 -36.86 27.19 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 119.746 -1.846 . . . . 0.0 110.337 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.643 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.2 Cg_exo -67.07 -56.39 0.24 Allowed 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.145 1.896 . . . . 0.0 111.855 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.76 -43.44 85.45 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -72.95 -49.9 26.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.301 -0.874 . . . . 0.0 110.641 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.4 t -76.8 -43.05 38.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.156 -0.965 . . . . 0.0 111.199 -178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.5 tp10 -68.8 -50.35 50.93 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.577 -1.327 . . . . 0.0 110.996 -178.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -74.0 -35.76 64.44 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.115 -0.991 . . . . 0.0 111.699 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.2 tptp -111.02 -29.04 8.06 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.838 -1.163 . . . . 0.0 111.612 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 54.61 44.67 28.3 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.643 -1.286 . . . . 0.0 110.607 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.662 HD11 HG23 ' A' ' 64' ' ' ILE . 73.5 mt -66.07 -30.88 71.48 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.117 -0.989 . . . . 0.0 110.398 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -154.24 -166.7 2.43 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.406 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 74.2 p -127.53 159.81 63.82 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.595 -0.691 . . . . 0.0 109.753 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.45 -39.28 90.24 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.613 1.542 . . . . 0.0 112.256 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.59 -37.95 89.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.969 -1.082 . . . . 0.0 109.775 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -66.4 -44.73 82.2 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD21 ' HG2' ' A' ' 103' ' ' MET . 26.6 tp -66.66 -51.72 53.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.349 0.595 . . . . 0.0 110.08 179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -57.74 -47.02 83.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.0 109.863 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.13 91.91 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.238 -0.914 . . . . 0.0 109.877 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.96 -34.33 75.15 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.939 0.876 . . . . 0.0 108.7 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.7 HD11 ' SD ' ' A' ' 103' ' ' MET . 13.2 mt -63.59 -52.24 60.12 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -61.74 -36.85 82.17 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.458 -0.897 . . . . 0.0 109.04 179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.84 -31.64 81.08 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.671 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 3.9 p30 -90.92 -35.62 14.62 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.055 -1.262 . . . . 0.0 111.183 -178.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.502 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 72.7 mtm180 . . . . . 0 N--CA 1.492 1.667 0 O-C-N 120.714 -1.241 . . . . 0.0 110.203 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.752 ' O ' HG13 ' A' ' 13' ' ' VAL . 1.8 mp0 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.17 -50.82 70.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.405 -0.809 . . . . 0.0 109.322 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.66 -41.66 99.18 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.055 -1.028 . . . . 0.0 109.213 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.58 -48.16 75.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.337 -0.852 . . . . 0.0 110.586 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.0 m -69.68 -37.15 73.34 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 120.674 -1.266 . . . . 0.0 107.796 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -54.52 -41.52 69.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 mm-40 -58.95 -29.91 67.49 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.304 -0.958 . . . . 0.0 108.762 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 46' ' ' LEU . 8.9 mt -72.42 -38.45 68.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 111.333 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.44 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.0 m-85 -76.67 -33.53 58.27 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.509 -1.369 . . . . 0.0 110.457 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.3 mt-10 -65.72 -26.92 67.97 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.844 -1.16 . . . . 0.0 110.325 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.598 HG21 HH12 ' A' ' 25' ' ' ARG . 32.9 mt -38.39 -40.28 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 O-C-N 121.604 -0.685 . . . . 0.0 110.665 -179.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -170.74 164.45 8.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.744 -1.223 . . . . 0.0 110.758 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -89.84 68.38 7.41 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.396 0.617 . . . . 0.0 109.774 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -112.44 94.28 26.57 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.13 -41.72 40.61 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.01 1.807 . . . . 0.0 111.974 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -63.38 -41.72 98.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.107 -0.996 . . . . 0.0 108.611 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.598 HH12 HG21 ' A' ' 19' ' ' ILE . 66.3 ttt180 -58.68 -37.78 76.79 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.432 -0.793 . . . . 0.0 109.297 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.74 -49.35 78.06 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.359 -0.838 . . . . 0.0 108.845 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.62 -37.75 65.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.554 -0.716 . . . . 0.0 109.365 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.48 -61.22 2.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.269 -0.894 . . . . 0.0 110.695 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.45 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 54.7 mt -54.7 -47.56 73.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.284 -0.885 . . . . 0.0 109.295 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.44 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 88.1 m-20 -62.13 -46.17 90.19 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.821 -0.752 . . . . 0.0 109.395 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -67.1 -44.42 80.04 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.189 -0.944 . . . . 0.0 109.389 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.8 tp -55.56 -51.26 67.68 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.429 -0.795 . . . . 0.0 109.924 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.9 m-85 -61.0 -34.83 75.42 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 118.442 -1.303 . . . . 0.0 107.85 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -70.78 -52.84 18.08 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.559 -0.713 . . . . 0.0 110.524 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.68 -45.04 90.29 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.271 -0.893 . . . . 0.0 111.124 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.6 mtp -58.38 -33.57 69.75 Favored 'General case' 0 C--N 1.296 -1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.22 -179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -52.78 -39.12 61.99 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.96 -1.087 . . . . 0.0 108.652 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 38' ' ' LYS . 39.3 mmtt -71.03 -37.35 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -65.21 -30.45 71.35 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.76 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.73 0.74 64.11 Favored Glycine 0 N--CA 1.485 1.965 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.5 p -117.21 84.81 17.86 Favored Pre-proline 0 N--CA 1.491 1.58 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -83.77 141.14 9.53 Favored 'Trans proline' 0 C--N 1.301 -1.945 0 C-N-CA 122.507 2.138 . . . . 0.0 111.4 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.4 mt -76.36 97.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.997 -1.064 . . . . 0.0 109.725 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.487 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 24.5 t-20 -68.15 -45.94 72.18 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -130.03 132.16 46.12 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 16' ' ' LEU . 17.7 mt -70.17 128.3 91.61 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 120.889 -1.132 . . . . 0.0 109.879 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -53.32 126.35 21.37 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 N-CA-C 108.777 -1.278 . . . . 0.0 108.777 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.2 mt -99.34 142.28 15.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.946 -1.096 . . . . 0.0 110.187 -178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.647 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.6 mtp -137.99 124.43 20.7 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.77 40.42 3.21 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 57.27 22.84 8.11 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.332 0.587 . . . . 0.0 110.286 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.1 p -136.08 153.42 51.33 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.187 -0.946 . . . . 0.0 109.079 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -66.74 145.62 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.984 -1.072 . . . . 0.0 108.941 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.647 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.6 tp -80.14 124.44 28.78 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.271 -0.893 . . . . 0.0 110.023 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.592 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.0 m-20 -63.73 88.59 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -52.42 -24.86 8.55 Favored 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.883 -1.136 . . . . 0.0 109.235 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -80.3 -57.86 3.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.237 -0.914 . . . . 0.0 111.938 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -56.81 -38.24 72.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.525 -1.359 . . . . 0.0 109.34 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.51 HD22 HD21 ' A' ' 54' ' ' LEU . 60.0 tp -58.75 -52.4 65.86 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.419 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -51.91 -66.36 0.4 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.374 0.607 . . . . 0.0 109.832 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -42.83 -43.11 3.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.508 -0.745 . . . . 0.0 111.636 -178.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.49 -40.75 70.02 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.136 -1.426 . . . . 0.0 107.402 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.787 HG21 ' CE2' ' A' ' 102' ' ' TYR . 44.1 t -60.99 -45.5 98.41 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 C-N-CA 119.611 -0.836 . . . . 0.0 109.516 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.419 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.9 mm -68.75 -45.97 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.747 -1.22 . . . . 0.0 107.886 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -4.66 2.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.807 -0.558 . . . . 0.0 109.683 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.682 ' HG3' HD13 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -101.89 9.39 40.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.103 -0.998 . . . . 0.0 108.841 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.51 7.85 87.72 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.348 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 122.8 142.63 6.21 Favored Glycine 0 N--CA 1.501 2.989 0 O-C-N 121.015 -1.285 . . . . 0.0 110.999 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' OE2' ' A' ' 110' ' ' GLU . 14.8 tp -52.18 -41.41 62.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.714 -0.874 . . . . 0.0 110.77 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.481 HG11 ' HB3' ' A' ' 121' ' ' GLU . 76.2 t -57.25 -41.76 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.747 -1.221 . . . . 0.0 108.916 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -59.07 -38.79 80.28 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.936 -1.102 . . . . 0.0 109.381 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.2 t -61.8 -46.86 95.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.329 -0.857 . . . . 0.0 110.208 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.9 mt -63.9 -61.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.072 -1.018 . . . . 0.0 109.979 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -58.89 -41.33 86.9 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.577 -0.702 . . . . 0.0 110.831 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -93.2 -7.36 45.45 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.978 -1.076 . . . . 0.0 110.985 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 72' ' ' VAL . 22.6 mtmt 57.4 56.99 4.66 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.125 -0.985 . . . . 0.0 110.492 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.682 HD13 ' HG3' ' A' ' 66' ' ' ARG . 18.2 mt -89.53 13.11 14.71 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.4 m95 -62.42 -42.86 99.76 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.635 -0.666 . . . . 0.0 109.362 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.3 mm-40 -49.69 -38.32 32.53 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.806 -1.184 . . . . 0.0 108.33 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.581 ' OE1' ' NE ' ' A' ' 66' ' ' ARG . 98.6 mt-10 -68.92 -40.48 79.03 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -72.47 -54.28 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.473 -0.767 . . . . 0.0 109.172 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.51 HD11 ' HB2' ' A' ' 95' ' ' ALA . 73.1 mt -53.15 -52.87 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 121.26 -0.9 . . . . 0.0 109.219 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -69.27 -40.28 77.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 109.344 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.73 -33.73 42.81 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.8 mt -87.66 -8.32 56.31 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.376 -1.073 . . . . 0.0 108.851 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 65.26 39.89 5.15 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.4 mt -73.03 139.71 79.91 Favored Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.338 -0.851 . . . . 0.0 108.752 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.6 Cg_endo -67.26 142.57 61.06 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.946 1.764 . . . . 0.0 111.892 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -61.37 1.16 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.268 -0.895 . . . . 0.0 109.826 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 88' ' ' PRO . 60.4 p -65.65 -24.31 67.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.263 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.483 HD11 ' H ' ' A' ' 50' ' ' ALA . 90.9 mt -98.13 106.31 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.957 -1.089 . . . . 0.0 109.001 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -78.5 -22.57 47.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.107 -0.995 . . . . 0.0 108.657 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 27.8 m -95.49 34.29 1.48 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.01 -65.9 0.62 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.067 -1.021 . . . . 0.0 108.854 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.51 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.66 -52.85 27.97 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.304 -0.873 . . . . 0.0 109.52 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.488 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.4 tp -58.53 -44.29 89.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.861 -1.149 . . . . 0.0 109.044 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 m -61.79 -40.96 97.03 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 120.942 -1.099 . . . . 0.0 109.441 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.501 HD22 HD13 ' A' ' 59' ' ' LEU . 9.4 mt -68.38 -45.83 71.66 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.399 -0.813 . . . . 0.0 110.298 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.623 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 34.9 ttp180 -64.45 -49.85 69.85 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.136 -0.978 . . . . 0.0 110.622 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -56.16 -54.82 40.59 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.112 -0.992 . . . . 0.0 109.804 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -62.58 -42.59 99.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.063 -1.023 . . . . 0.0 111.024 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.787 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -56.97 -43.17 81.36 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 120.441 -1.412 . . . . 0.0 109.44 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.66 ' CE ' HD11 ' A' ' 126' ' ' ILE . 42.5 mtt -54.32 -53.9 47.59 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.491 -0.755 . . . . 0.0 111.185 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.1 mttm -72.25 -57.14 4.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.895 -1.128 . . . . 0.0 112.47 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -83.02 -15.09 52.49 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -175.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 mt -137.17 17.87 2.98 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 120.082 -1.636 . . . . 0.0 112.893 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.631 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 37.6 t80 -72.08 -35.01 3.17 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 120.153 -1.592 . . . . 0.0 110.617 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.9 Cg_endo -83.79 -39.06 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.757 1.638 . . . . 0.0 112.799 -179.014 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.61 -41.55 86.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.625 -1.297 . . . . 0.0 107.857 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.469 ' OE2' ' N ' ' A' ' 69' ' ' LEU . 79.0 tt0 -71.86 -50.79 26.39 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.538 -0.726 . . . . 0.0 110.067 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.578 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -74.92 -44.0 51.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.496 -0.753 . . . . 0.0 111.083 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 38.8 tp10 -66.08 -47.36 74.53 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.901 -1.124 . . . . 0.0 110.605 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -74.87 -33.94 62.16 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.162 -0.961 . . . . 0.0 111.163 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG2' HD21 ' A' ' 116' ' ' LEU . 32.8 tptt -120.52 -27.98 5.04 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.186 -0.946 . . . . 0.0 111.848 -177.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.578 ' N ' ' O ' ' A' ' 111' ' ' CYS . 35.5 t-20 57.25 44.91 21.25 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.564 -1.335 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.458 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.5 mt -67.52 -30.39 70.03 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.201 -0.937 . . . . 0.0 111.249 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.577 ' OG ' ' N ' ' A' ' 118' ' ' THR . 8.8 t -153.13 -169.1 3.22 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 118.553 -1.259 . . . . 0.0 111.743 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.577 ' N ' ' OG ' ' A' ' 117' ' ' SER . 70.1 p -126.47 163.23 41.85 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.754 -0.592 . . . . 0.0 109.643 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.6 -37.95 85.08 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 121.571 1.514 . . . . 0.0 111.971 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.54 -36.72 83.51 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.995 . . . . 0.0 109.037 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.481 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.5 mt-10 -66.87 -48.78 67.71 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.603 HD11 ' CE ' ' A' ' 103' ' ' MET . 56.5 tp -57.54 -58.01 10.18 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.525 -0.735 . . . . 0.0 109.974 178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 126' ' ' ILE . 18.0 mm100 -56.8 -45.71 82.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.496 -0.753 . . . . 0.0 109.394 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.13 -36.5 77.65 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.802 -1.186 . . . . 0.0 108.466 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.18 -35.91 74.29 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.66 HD11 ' CE ' ' A' ' 103' ' ' MET . 19.3 mt -60.14 -52.5 60.58 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -64.31 -38.03 89.58 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.01 -30.25 69.71 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.85 -32.88 13.05 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.846 -1.385 . . . . 0.0 110.94 -178.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 O-C-N 120.773 -1.204 . . . . 0.0 109.362 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.9 mm100 . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.65 ' CZ ' ' NE ' ' A' ' 14' ' ' ARG . 52.4 t80 -54.91 -50.18 69.44 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.29 -0.881 . . . . 0.0 108.95 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -62.86 -40.78 98.55 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.025 -1.047 . . . . 0.0 109.59 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.65 -47.98 73.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.832 . . . . 0.0 111.006 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.697 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -70.11 -38.06 73.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 120.702 -1.249 . . . . 0.0 108.992 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.65 ' NE ' ' CZ ' ' A' ' 10' ' ' PHE . 7.7 mmt-85 -55.91 -39.82 72.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.392 -1.443 . . . . 0.0 108.347 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -58.71 -29.0 66.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.453 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -75.32 -39.51 59.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.404 -0.81 . . . . 0.0 111.634 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.4 m-85 -74.86 -34.16 62.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.5 -1.375 . . . . 0.0 110.578 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 19' ' ' ILE . 77.8 mm-40 -64.77 -26.99 68.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.923 -1.111 . . . . 0.0 110.154 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.49 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 41.8 mt -39.87 -40.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.72 -0.612 . . . . 0.0 110.652 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.49 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.4 m120 -171.13 160.95 6.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.716 -1.24 . . . . 0.0 110.448 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 52.3 p30 -91.65 64.42 4.9 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.49 0.662 . . . . 0.0 109.724 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.0 107.66 60.83 Favored Pre-proline 0 N--CA 1.489 1.502 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -46.87 -51.78 8.68 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.031 1.821 . . . . 0.0 112.513 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.16 -36.1 78.89 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.169 -0.957 . . . . 0.0 109.337 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.688 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -59.41 -44.97 92.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -62.32 -53.27 57.51 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.308 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -51.69 -37.67 51.75 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.525 -0.735 . . . . 0.0 109.208 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -62.01 -62.58 1.69 Allowed 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.468 -0.77 . . . . 0.0 110.318 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.495 HD11 ' NH1' ' A' ' 25' ' ' ARG . 57.5 mt -54.77 -45.45 74.24 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.487 -0.758 . . . . 0.0 109.148 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -61.73 -47.64 84.3 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.035 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -66.68 -44.82 80.75 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.415 -0.803 . . . . 0.0 109.762 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.43 -51.74 67.25 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.349 -0.844 . . . . 0.0 110.898 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.415 ' CE1' HD12 ' A' ' 43' ' ' ILE . 42.0 m-85 -62.53 -33.06 74.15 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 118.104 -1.438 . . . . 0.0 108.207 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 m -68.99 -55.03 12.13 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.408 -0.807 . . . . 0.0 110.203 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.438 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 46.3 t80 -61.91 -38.45 88.43 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.894 . . . . 0.0 111.656 -178.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.5 mmm -58.22 -34.79 70.8 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.857 -1.152 . . . . 0.0 110.748 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -56.27 -37.63 70.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.772 -1.205 . . . . 0.0 109.25 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.1 -28.47 57.53 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 13.6 mmm180 -66.7 -32.05 73.1 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.733 -0.787 . . . . 0.0 109.428 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.55 -2.21 62.49 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.725 -2.15 . . . . 0.0 107.725 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.8 p -118.72 84.9 26.18 Favored Pre-proline 0 N--CA 1.49 1.545 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.17 12.34 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.527 2.151 . . . . 0.0 111.207 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.504 HG21 HD23 ' A' ' 46' ' ' LEU . 59.1 mt -80.82 99.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.048 -1.032 . . . . 0.0 110.042 -178.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -79.11 -3.96 47.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.25 -0.906 . . . . 0.0 108.648 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -176.45 123.2 0.16 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.279 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD23 HG21 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -70.29 144.06 91.66 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 120.953 -1.092 . . . . 0.0 108.93 -179.368 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -67.08 138.85 48.89 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 121.501 1.467 . . . . 0.0 109.558 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.547 HG23 ' N ' ' A' ' 52' ' ' SER . 35.3 mt -105.55 142.69 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.02 -1.05 . . . . 0.0 110.269 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.58 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.3 mtp -134.52 125.71 27.89 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.49 40.03 8.59 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.5 mttt 58.94 25.02 13.22 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.857 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.547 ' N ' HG23 ' A' ' 48' ' ' ILE . 84.8 p -137.56 154.58 49.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.369 -0.832 . . . . 0.0 109.524 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.26 144.3 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.197 -0.939 . . . . 0.0 109.975 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.695 HD21 HD22 ' A' ' 59' ' ' LEU . 51.0 tp -77.16 122.63 25.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.544 -0.722 . . . . 0.0 109.396 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -61.86 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.656 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.28 -26.87 42.86 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 120.92 -1.112 . . . . 0.0 109.149 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -78.1 -63.46 1.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.136 -0.978 . . . . 0.0 111.564 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -57.1 -38.73 73.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.684 -1.26 . . . . 0.0 110.267 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.695 HD22 HD21 ' A' ' 54' ' ' LEU . 39.9 tp -58.72 -43.47 90.14 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.546 -1.346 . . . . 0.0 107.853 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.586 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 55.2 t80 -60.03 -67.5 0.38 Allowed 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.412 0.625 . . . . 0.0 109.547 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -41.94 -41.4 2.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.515 -0.74 . . . . 0.0 111.429 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.1 -44.07 69.74 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.12 -1.432 . . . . 0.0 107.743 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.827 HG21 ' CE2' ' A' ' 102' ' ' TYR . 23.5 t -58.14 -45.22 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.393 -0.817 . . . . 0.0 110.403 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.586 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.1 mm -71.01 -33.43 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 120.735 -1.228 . . . . 0.0 108.313 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.47 -24.38 20.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.646 -178.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.496 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.9 mpt_? -92.46 -2.55 56.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.809 -1.182 . . . . 0.0 108.799 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.1 16.74 66.55 Favored Glycine 0 N--CA 1.491 2.312 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.434 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 145.28 128.11 2.0 Allowed Glycine 0 N--CA 1.498 2.801 0 CA-C-N 119.675 1.737 . . . . 0.0 111.85 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.616 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.9 tp -46.92 -38.33 10.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.63 -0.924 . . . . 0.0 109.695 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 88.0 t -60.61 -41.19 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.455 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -58.61 -42.99 89.46 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.878 -1.139 . . . . 0.0 109.695 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 76' ' ' LYS . 61.9 t -59.68 -43.43 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 109.349 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -66.84 -56.89 12.13 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 120.851 -1.156 . . . . 0.0 109.623 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.463 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.7 m-20 -57.79 -41.77 82.8 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.161 -0.962 . . . . 0.0 110.312 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -92.27 -9.58 41.55 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.178 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.616 ' N ' ' O ' ' A' ' 72' ' ' VAL . 28.3 mtmt 58.03 57.7 3.94 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -0.868 . . . . 0.0 109.67 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 12.6 mt -92.98 16.6 12.33 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.949 -1.094 . . . . 0.0 108.52 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.1 m95 -64.26 -39.75 94.59 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.439 ' C ' ' O ' ' A' ' 78' ' ' TRP . 16.3 mm100 -48.81 -38.88 23.38 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.287 -1.365 . . . . 0.0 108.026 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.496 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.8 mm-40 -69.64 -40.92 76.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.83 -54.47 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.776 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.5 mt -50.33 -54.2 9.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -68.4 -38.49 81.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.77 -34.0 50.16 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.1 mt -88.13 -8.33 55.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.35 -1.088 . . . . 0.0 108.823 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 66.25 39.5 4.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.781 -0.575 . . . . 0.0 109.934 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.0 mt -73.79 146.74 85.86 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.547 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.7 Cg_endo -74.04 139.96 27.69 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 C-N-CA 122.081 1.854 . . . . 0.0 112.149 179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.1 p -56.38 -0.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.822 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.547 ' H ' ' C ' ' A' ' 88' ' ' PRO . 86.8 p -67.31 -24.2 65.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.157 -0.964 . . . . 0.0 110.12 -178.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 94' ' ' ALA . 81.5 mt -96.99 102.01 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 120.751 -1.218 . . . . 0.0 109.274 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 52.3 p -73.43 -28.04 61.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 108.899 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.4 m -92.04 30.51 1.41 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -61.83 -65.55 0.67 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.287 -0.883 . . . . 0.0 108.684 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.776 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.37 -51.27 35.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 109.178 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.04 -42.71 90.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.976 -1.077 . . . . 0.0 108.756 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 52.2 m -60.99 -40.84 95.03 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.246 -0.909 . . . . 0.0 108.707 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -69.29 -48.18 62.4 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.608 -0.682 . . . . 0.0 109.929 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -65.89 -49.03 69.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.144 -0.973 . . . . 0.0 110.919 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -55.83 -54.73 40.95 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 109.846 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.7 -40.9 98.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.274 -0.891 . . . . 0.0 111.115 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.827 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.78 -41.05 81.24 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.454 -1.404 . . . . 0.0 109.571 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.586 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.1 ttm -53.65 -54.1 42.6 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.426 -0.796 . . . . 0.0 111.552 -178.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -72.0 -54.5 9.72 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.661 -1.275 . . . . 0.0 113.164 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -85.41 -44.59 12.63 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 102' ' ' TYR . 3.0 mt -97.96 -7.69 29.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.315 -1.49 . . . . 0.0 114.231 -175.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.8 t80 -59.87 -38.18 57.48 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 119.84 -1.788 . . . . 0.0 109.209 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 15.8 Cg_exo -67.71 -52.07 0.6 Allowed 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.333 2.022 . . . . 0.0 112.036 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -60.67 -38.45 84.98 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.612 ' CG ' HD12 ' A' ' 116' ' ' LEU . 59.7 tt0 -73.33 -52.2 14.72 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.619 -0.676 . . . . 0.0 109.95 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 73.0 m -71.24 -43.87 66.42 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.475 -0.766 . . . . 0.0 110.888 -178.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -67.77 -47.12 70.07 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.018 -1.051 . . . . 0.0 111.407 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt -74.78 -33.59 62.29 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.99 -1.069 . . . . 0.0 112.145 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.47 -25.13 3.78 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.853 -1.154 . . . . 0.0 111.641 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 60.64 48.76 7.0 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.687 -1.258 . . . . 0.0 110.285 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.612 HD12 ' CG ' ' A' ' 110' ' ' GLU . 18.5 mt -67.1 -33.85 76.35 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.106 -0.996 . . . . 0.0 111.264 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.556 ' OG ' ' N ' ' A' ' 118' ' ' THR . 26.6 t -155.43 -166.62 2.3 Favored 'General case' 0 N--CA 1.496 1.828 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.315 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.556 ' N ' ' OG ' ' A' ' 117' ' ' SER . 69.7 p -130.6 156.76 79.26 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.562 -0.711 . . . . 0.0 110.078 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -51.72 -42.82 54.92 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 121.906 1.737 . . . . 0.0 112.493 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.98 -38.96 93.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.743 -1.223 . . . . 0.0 109.512 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -65.64 -43.57 89.06 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.586 HD21 ' HG3' ' A' ' 103' ' ' MET . 24.8 tp -68.49 -50.49 51.94 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.65 -0.656 . . . . 0.0 110.087 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -57.72 -46.38 84.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.052 -1.03 . . . . 0.0 109.167 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.21 96.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.405 -0.81 . . . . 0.0 109.941 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.463 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.0 -34.92 77.43 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.535 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -65.12 -48.13 84.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.72 -37.57 84.68 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.952 -1.092 . . . . 0.0 108.256 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.41 -33.0 86.07 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.6 p-10 -93.11 -31.77 14.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.797 -1.413 . . . . 0.0 110.267 -179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.6 mtp180 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 120.761 -1.212 . . . . 0.0 109.521 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.785 ' O ' HG13 ' A' ' 13' ' ' VAL . 24.9 mm-40 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.34 -51.31 70.36 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.175 -0.953 . . . . 0.0 109.388 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -63.29 -44.37 95.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.164 -0.96 . . . . 0.0 109.432 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -66.05 -48.54 70.71 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.881 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.785 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.3 m -69.5 -36.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.727 -1.233 . . . . 0.0 108.603 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -56.7 -39.4 73.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.495 -1.378 . . . . 0.0 107.863 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -58.34 -32.08 68.18 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.456 ' CD1' HD13 ' A' ' 46' ' ' LEU . 8.8 mt -71.35 -40.29 70.78 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.0 111.934 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -75.5 -32.92 60.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.452 -1.405 . . . . 0.0 110.119 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.466 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.4 mt-10 -67.08 -26.15 66.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.995 -1.066 . . . . 0.0 110.48 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.525 HD13 HH21 ' A' ' 25' ' ' ARG . 34.4 mt -38.36 -41.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 121.566 -0.708 . . . . 0.0 110.502 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.443 ' C ' ' OD1' ' A' ' 20' ' ' ASN . 36.5 p30 -172.71 165.65 5.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.873 -1.142 . . . . 0.0 110.309 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -91.1 69.52 6.2 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.663 -0.648 . . . . 0.0 109.63 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -112.19 103.87 55.62 Favored Pre-proline 0 N--CA 1.493 1.695 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -48.62 -42.92 35.19 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.066 1.844 . . . . 0.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -62.54 -38.03 88.44 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.276 -0.89 . . . . 0.0 108.805 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.664 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -60.54 -44.96 95.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.481 -0.762 . . . . 0.0 109.874 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.31 -53.87 48.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.226 -0.921 . . . . 0.0 109.729 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -51.77 -39.76 59.13 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.32 -60.5 3.31 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.425 -0.797 . . . . 0.0 109.933 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' NH1' ' A' ' 25' ' ' ARG . 72.7 mt -54.75 -46.91 74.38 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 109.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.519 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 93.6 m-20 -63.03 -47.34 83.47 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.458 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -67.09 -43.33 82.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.181 -0.949 . . . . 0.0 109.325 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.25 -51.51 69.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.342 -0.849 . . . . 0.0 110.345 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.02 -35.29 74.75 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 117.75 -1.58 . . . . 0.0 107.715 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -69.74 -51.48 33.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.596 -0.69 . . . . 0.0 110.599 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -59.55 -43.92 93.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.245 -0.91 . . . . 0.0 111.92 -178.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.0 mtp -57.38 -31.33 65.69 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 111.268 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -54.13 -40.37 67.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.493 -1.38 . . . . 0.0 108.553 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -65.99 -40.19 90.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.449 -0.782 . . . . 0.0 109.186 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -63.76 -30.69 71.76 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.632 -0.667 . . . . 0.0 110.194 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.57 1.55 68.43 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 107.914 -2.075 . . . . 0.0 107.914 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.1 p -118.8 84.45 25.42 Favored Pre-proline 0 N--CA 1.487 1.411 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.9 146.08 10.23 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.622 2.214 . . . . 0.0 111.397 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 11.7 mt -79.44 95.22 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 119.126 -1.03 . . . . 0.0 109.454 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.59 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 77.5 m-20 -64.4 -43.55 94.09 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -136.42 133.38 36.61 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.456 HD13 ' CD1' ' A' ' 16' ' ' LEU . 7.3 mt -69.98 132.49 88.49 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 120.777 -1.202 . . . . 0.0 108.714 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -58.99 140.11 93.87 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 N-CA-C 108.82 -1.262 . . . . 0.0 108.82 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 mt -106.22 146.02 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.954 -1.091 . . . . 0.0 110.839 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.852 ' SD ' HD13 ' A' ' 54' ' ' LEU . 82.6 mtp -143.54 121.11 11.76 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.18 39.45 1.71 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -178.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt 56.78 22.2 6.73 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.547 0.689 . . . . 0.0 109.576 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.1 m -132.19 150.52 52.14 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -67.65 146.72 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.832 -1.168 . . . . 0.0 108.966 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.852 HD13 ' SD ' ' A' ' 49' ' ' MET . 44.0 tp -74.6 118.06 17.14 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 109.778 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -62.27 93.26 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.327 -0.858 . . . . 0.0 108.95 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -54.09 -26.99 29.98 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.054 -1.029 . . . . 0.0 109.405 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -78.88 -59.34 2.82 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.118 -0.988 . . . . 0.0 111.666 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -57.41 -37.6 73.01 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.502 -1.374 . . . . 0.0 109.519 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.684 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.21 -46.66 87.87 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.479 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 46.2 t80 -61.28 -70.64 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.387 0.613 . . . . 0.0 109.551 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 60' ' ' TYR . 54.3 t30 -38.26 -40.83 0.56 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.657 -0.652 . . . . 0.0 111.01 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.569 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 52.0 mt -72.44 -46.67 53.98 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.356 -1.338 . . . . 0.0 108.277 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 18.9 t -56.37 -43.53 77.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.214 -0.929 . . . . 0.0 110.491 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.479 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.8 mm -70.42 -35.22 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.712 -1.243 . . . . 0.0 108.11 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.68 -19.68 17.7 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.765 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.638 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.3 mmt-85 -94.1 -0.38 55.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.735 -1.228 . . . . 0.0 108.234 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 14.13 80.16 Favored Glycine 0 N--CA 1.492 2.414 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.609 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.47 ' HA2' HD13 ' A' ' 116' ' ' LEU . . . 147.3 126.21 1.66 Allowed Glycine 0 N--CA 1.5 2.935 0 O-C-N 120.065 -1.844 . . . . 0.0 111.582 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.588 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.6 tp -47.33 -41.01 18.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.492 -1.005 . . . . 0.0 109.956 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.3 t -61.42 -42.19 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.031 -1.043 . . . . 0.0 110.197 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -54.98 -37.53 66.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 108.749 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.1 t -65.91 -43.07 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.521 -0.737 . . . . 0.0 110.502 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.9 mt -66.89 -58.65 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.701 -1.249 . . . . 0.0 110.239 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.459 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 96.3 m-20 -58.64 -40.75 84.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.157 -0.964 . . . . 0.0 110.544 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.4 mmtp -92.64 -10.2 38.21 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.157 -0.964 . . . . 0.0 110.614 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 72' ' ' VAL . 49.5 mttp 58.69 56.96 3.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.519 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.46 15.72 10.2 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.837 -1.164 . . . . 0.0 108.12 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.52 ' NE1' HG12 ' A' ' 72' ' ' VAL . 92.9 m95 -65.14 -40.82 94.95 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.447 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.0 mm-40 -49.06 -38.43 24.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.192 -1.403 . . . . 0.0 107.995 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.638 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.0 mt-10 -69.14 -40.86 77.98 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.498 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.9 mt -71.67 -52.48 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.637 HD11 ' HB2' ' A' ' 95' ' ' ALA . 83.8 mt -51.85 -53.75 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.633 -0.667 . . . . 0.0 110.115 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 79' ' ' GLN . 59.9 mttp -70.88 -37.56 73.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.77 -1.206 . . . . 0.0 110.019 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -54.96 -33.7 57.18 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.264 -1.535 . . . . 0.0 109.264 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.2 mt -86.7 -10.54 53.48 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.4 -1.059 . . . . 0.0 108.566 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 67.78 40.66 2.37 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.34 0.59 . . . . 0.0 110.513 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.72 141.55 79.31 Favored Pre-proline 0 N--CA 1.487 1.405 0 O-C-N 121.157 -0.964 . . . . 0.0 108.634 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.559 ' C ' ' H ' ' A' ' 90' ' ' SER . 39.8 Cg_endo -71.59 142.03 39.31 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 121.979 1.786 . . . . 0.0 112.076 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.0 p -55.73 0.01 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.559 ' H ' ' C ' ' A' ' 88' ' ' PRO . 20.4 m -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.077 -1.015 . . . . 0.0 109.937 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.3 mt -92.86 101.57 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 120.781 -1.199 . . . . 0.0 109.258 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -71.26 -29.53 65.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.226 -0.921 . . . . 0.0 109.179 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.3 m -96.32 40.07 1.14 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.46 -0.775 . . . . 0.0 109.472 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -62.6 1.51 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.945 . . . . 0.0 108.721 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.637 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.6 -51.06 22.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.289 -0.882 . . . . 0.0 109.694 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.409 HD12 HH21 ' A' ' 99' ' ' ARG . 7.1 tp -58.53 -41.22 85.0 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.603 -1.31 . . . . 0.0 108.61 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.623 HG22 HE22 ' A' ' 101' ' ' GLN . 35.8 m -63.87 -41.31 97.78 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.272 -0.893 . . . . 0.0 109.271 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.423 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -68.49 -46.35 69.92 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.266 -0.896 . . . . 0.0 110.692 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.752 ' NH1' HD21 ' A' ' 129' ' ' ASN . 34.6 ttp180 -68.17 -48.57 64.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.137 -0.977 . . . . 0.0 110.833 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.9 m -55.54 -53.54 55.13 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.058 -1.026 . . . . 0.0 110.017 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.623 HE22 HG22 ' A' ' 97' ' ' THR . 8.4 mt-30 -64.68 -41.19 96.23 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.954 -1.091 . . . . 0.0 111.548 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.3 t80 -57.23 -41.98 80.56 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 120.317 -1.489 . . . . 0.0 109.007 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.697 ' HG2' HD21 ' A' ' 122' ' ' LEU . 83.1 mtp -54.24 -57.69 10.23 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-O 121.471 0.653 . . . . 0.0 112.246 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -71.17 -51.47 24.67 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.414 -1.429 . . . . 0.0 112.099 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' HD12 ' A' ' 106' ' ' LEU . 60.6 m-85 -84.67 -46.14 11.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -175.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.9 mp -103.13 11.97 36.41 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.355 -1.466 . . . . 0.0 113.835 -176.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.541 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.5 t80 -68.79 -38.4 11.65 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 119.903 -1.748 . . . . 0.0 111.492 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 86.9 Cg_endo -79.1 -41.57 0.22 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.535 1.49 . . . . 0.0 112.514 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -58.47 -41.92 86.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.856 -1.152 . . . . 0.0 107.975 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.492 ' CG ' HD12 ' A' ' 116' ' ' LEU . 61.3 tt0 -70.65 -49.58 45.9 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.443 0.64 . . . . 0.0 110.213 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.516 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.5 t -74.82 -44.43 49.33 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.379 -0.826 . . . . 0.0 110.675 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.0 tp10 -66.4 -46.05 77.93 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.347 -0.846 . . . . 0.0 111.061 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -75.08 -33.2 61.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.039 -1.038 . . . . 0.0 111.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.02 -25.18 3.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.844 -1.16 . . . . 0.0 112.133 -177.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.0 t-20 59.26 50.7 7.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.579 -1.326 . . . . 0.0 110.506 178.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.492 HD12 ' CG ' ' A' ' 110' ' ' GLU . 26.2 mt -68.37 -32.17 72.06 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.346 -0.847 . . . . 0.0 111.839 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 10.0 t -154.66 -167.02 2.48 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 118.465 -1.294 . . . . 0.0 111.502 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.7 p -123.77 160.3 52.02 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 121.771 -0.58 . . . . 0.0 109.574 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -59.98 -38.69 76.75 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.348 1.365 . . . . 0.0 112.007 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.56 86.71 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.987 -1.071 . . . . 0.0 109.561 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.25 -48.37 67.95 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.697 HD21 ' HG2' ' A' ' 103' ' ' MET . 39.8 tp -63.22 -53.2 56.85 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.486 -0.759 . . . . 0.0 109.92 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -57.76 -44.33 86.09 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.002 -1.061 . . . . 0.0 109.235 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.18 91.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.738 . . . . 0.0 111.074 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.459 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -69.2 -32.08 71.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.027 -1.046 . . . . 0.0 109.17 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.684 ' CG2' ' NH2' ' A' ' 130' ' ' ARG . 12.0 mt -63.58 -49.42 82.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.001 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.17 -35.93 78.82 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.45 -17.9 67.04 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.752 HD21 ' NH1' ' A' ' 99' ' ' ARG . 17.2 p-10 -94.3 -30.58 14.46 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.842 -1.387 . . . . 0.0 110.644 -179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.684 ' NH2' ' CG2' ' A' ' 126' ' ' ILE . 1.1 mtt-85 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 120.65 -1.281 . . . . 0.0 110.112 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.969 ' O ' HG12 ' A' ' 13' ' ' VAL . 4.9 mm100 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 120.883 0.373 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.02 -46.67 84.91 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.291 -0.881 . . . . 0.0 109.826 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -62.27 -43.69 98.25 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.009 -1.057 . . . . 0.0 109.54 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -65.91 -50.21 65.25 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.457 -0.777 . . . . 0.0 111.09 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.969 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.2 p -68.15 -39.02 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.705 -1.247 . . . . 0.0 109.455 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.52 -38.35 87.06 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.274 -1.516 . . . . 0.0 107.757 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -56.22 -32.41 64.42 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.085 -1.046 . . . . 0.0 108.179 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.483 ' HB3' HD13 ' A' ' 29' ' ' LEU . 6.5 mt -66.85 -41.2 87.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.316 -0.865 . . . . 0.0 111.734 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -75.7 -36.59 59.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.363 -1.461 . . . . 0.0 109.88 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -70.3 -3.86 19.27 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.072 -1.018 . . . . 0.0 110.97 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.652 HG21 ' NH1' ' A' ' 25' ' ' ARG . 8.9 mt -56.66 -41.42 74.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 O-C-N 121.236 -0.915 . . . . 0.0 109.467 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -171.85 166.41 6.43 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.058 -1.026 . . . . 0.0 110.397 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.496 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.9 p30 -89.22 67.27 7.86 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.641 -0.662 . . . . 0.0 110.835 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.43 ' C ' ' OD1' ' A' ' 22' ' ' ASP . 8.8 t0 -112.17 95.41 30.15 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.12 -41.65 33.65 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 122.207 1.938 . . . . 0.0 112.794 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -62.56 -40.03 95.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.908 -1.12 . . . . 0.0 108.752 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.652 ' NH1' HG21 ' A' ' 19' ' ' ILE . 63.1 ttt180 -59.69 -36.12 75.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 110.11 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -60.15 -52.94 63.17 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.403 -0.811 . . . . 0.0 109.354 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -52.65 -38.3 60.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.471 -0.768 . . . . 0.0 109.971 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -64.48 -59.74 3.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.081 -1.012 . . . . 0.0 110.81 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.483 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.7 mt -52.93 -47.91 67.7 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.041 -1.037 . . . . 0.0 108.791 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -61.93 -45.14 95.01 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.418 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.1 -46.73 73.33 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.218 -0.926 . . . . 0.0 109.843 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.5 tp -57.21 -47.78 80.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.224 -0.922 . . . . 0.0 110.276 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CE2' HG23 ' A' ' 13' ' ' VAL . 47.7 m-85 -61.89 -36.6 81.78 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.19 -1.404 . . . . 0.0 107.679 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -70.24 -53.12 18.31 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.564 -0.71 . . . . 0.0 109.975 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 74.6 t80 -59.2 -42.08 90.06 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.375 -0.828 . . . . 0.0 111.172 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mmm -57.23 -34.85 68.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.944 . . . . 0.0 110.443 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -54.63 -39.92 68.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 109.362 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -74.89 -30.21 61.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 108.793 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 14.6 mmm180 -65.72 -30.85 71.58 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.742 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.93 -0.63 69.78 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.5 p -116.68 84.48 15.4 Favored Pre-proline 0 N--CA 1.488 1.468 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -83.14 139.03 9.25 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 122.558 2.172 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.9 mt -73.75 96.76 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.091 -1.005 . . . . 0.0 110.246 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.433 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 81.9 m-20 -60.52 -33.99 73.44 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -158.98 139.24 12.24 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.462 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.92 125.37 92.0 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.032 -1.043 . . . . 0.0 110.157 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -53.21 139.52 62.99 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.7 mt -103.11 146.7 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.867 -1.146 . . . . 0.0 110.714 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 73.2 mmm -137.41 127.06 25.27 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 56.85 42.89 25.83 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.93 24.51 12.64 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.365 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -135.05 153.84 51.92 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.182 -0.949 . . . . 0.0 109.324 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.2 m -67.27 142.09 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 120.983 -1.073 . . . . 0.0 109.387 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 HD22 ' A' ' 59' ' ' LEU . 64.8 tp -75.16 123.48 25.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.307 -0.871 . . . . 0.0 110.012 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.595 ' CG ' HH22 ' A' ' 25' ' ' ARG . 38.5 m-20 -59.56 99.96 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.521 -0.737 . . . . 0.0 109.719 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.6 -30.32 71.25 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.074 -1.016 . . . . 0.0 109.234 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -80.85 -60.56 2.26 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.291 -0.881 . . . . 0.0 111.578 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -54.1 -38.16 65.07 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.666 -1.271 . . . . 0.0 108.584 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.639 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.95 -46.37 89.64 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.441 ' CE2' HG13 ' A' ' 64' ' ' ILE . 54.0 t80 -59.37 -66.38 0.52 Allowed 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 121.485 0.659 . . . . 0.0 109.731 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -42.92 -42.11 3.59 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.582 -0.699 . . . . 0.0 111.552 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.99 -43.63 64.78 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.059 -1.456 . . . . 0.0 108.066 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 36.1 t -58.98 -44.35 90.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.239 -0.913 . . . . 0.0 109.334 179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.441 HG13 ' CE2' ' A' ' 60' ' ' TYR . 15.7 mm -69.55 -38.72 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 120.738 -1.226 . . . . 0.0 108.403 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.89 -19.93 7.7 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.812 -0.555 . . . . 0.0 110.13 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.553 ' CG ' HD13 ' A' ' 77' ' ' LEU . 7.0 mpt_? -95.06 -0.82 53.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.584 -1.323 . . . . 0.0 108.957 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.63 72.56 Favored Glycine 0 N--CA 1.492 2.404 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.263 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.1 131.52 2.46 Favored Glycine 0 N--CA 1.498 2.806 0 CA-C-N 119.722 1.761 . . . . 0.0 111.703 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.485 HD11 ' CH2' ' A' ' 78' ' ' TRP . 20.1 tp -52.64 -38.97 61.27 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.678 -0.895 . . . . 0.0 109.738 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 77.8 t -56.15 -43.64 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.202 -0.936 . . . . 0.0 108.97 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -59.15 -40.2 84.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.166 -0.959 . . . . 0.0 110.025 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.595 ' O ' ' N ' ' A' ' 76' ' ' LYS . 60.5 t -63.64 -43.99 98.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 120.741 -1.224 . . . . 0.0 109.551 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 33.7 mt -65.04 -61.53 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 120.758 -1.214 . . . . 0.0 110.182 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -58.48 -41.38 85.17 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.156 -0.965 . . . . 0.0 110.764 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -10.03 44.13 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.95 -1.093 . . . . 0.0 110.261 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' VAL . 21.4 mtmm 58.69 60.66 2.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.29 -0.881 . . . . 0.0 110.951 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.553 HD13 ' CG ' ' A' ' 66' ' ' ARG . 13.0 mt -95.42 14.22 23.32 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.104 -0.998 . . . . 0.0 108.55 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' A' ' 82' ' ' ILE . 98.8 m95 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.36 -0.837 . . . . 0.0 109.03 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.445 ' C ' ' O ' ' A' ' 78' ' ' TRP . 80.5 mt-30 -48.13 -38.83 18.77 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.537 -1.352 . . . . 0.0 108.437 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.8 mm-40 -67.85 -38.61 83.35 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 178.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.3 mt -74.25 -51.41 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.68 HD11 ' HB2' ' A' ' 95' ' ' ALA . 57.3 mt -52.0 -56.05 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.49 -37.07 68.53 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.374 -0.829 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -51.85 -34.7 37.96 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.49 -4.92 55.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.373 -1.075 . . . . 0.0 109.039 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 65.72 38.98 5.01 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.642 0.734 . . . . 0.0 109.16 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.24 145.75 86.03 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.411 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.0 Cg_endo -71.06 136.68 30.11 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.281 1.987 . . . . 0.0 112.415 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 t -62.79 -0.7 0.7 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 88' ' ' PRO . 77.9 p -64.64 -25.56 68.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.987 -1.07 . . . . 0.0 109.551 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.25 99.5 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.99 -1.069 . . . . 0.0 108.748 178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 40.8 p -68.35 -31.12 70.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.108 -0.995 . . . . 0.0 108.851 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -88.07 29.25 0.96 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.23 -67.35 0.38 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.4 -0.813 . . . . 0.0 108.976 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.03 -47.54 33.51 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.644 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.8 -45.53 92.06 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.33 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 36.2 m -61.63 -39.75 92.41 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.02 -1.05 . . . . 0.0 108.616 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.8 mt -70.9 -43.99 67.19 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.509 -0.745 . . . . 0.0 109.725 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.455 HH21 HD22 ' A' ' 129' ' ' ASN . 3.6 tmm_? -66.24 -51.28 59.09 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.111 -0.993 . . . . 0.0 110.66 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.2 m -57.11 -54.69 43.91 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.552 -0.718 . . . . 0.0 110.996 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -62.61 -41.2 98.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.986 -1.071 . . . . 0.0 111.393 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.9 t80 -57.32 -41.63 80.29 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.545 -1.347 . . . . 0.0 109.344 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.712 ' CE ' HD11 ' A' ' 126' ' ' ILE . 35.3 ttm -53.81 -52.89 58.88 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.823 -0.548 . . . . 0.0 111.313 -178.248 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -71.17 -54.84 9.62 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.811 -1.181 . . . . 0.0 112.732 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.467 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -84.86 -45.8 11.94 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -174.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.646 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.4 mp -97.4 -7.74 31.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.121 -1.612 . . . . 0.0 114.255 -175.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.634 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 26.6 t80 -57.94 -38.3 65.2 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 119.822 -1.799 . . . . 0.0 110.006 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 24.4 Cg_exo -65.0 -54.43 0.66 Allowed 'Trans proline' 0 N--CA 1.5 1.881 0 C-N-CA 122.513 2.142 . . . . 0.0 112.793 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.23 -44.07 88.04 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.178 -0.951 . . . . 0.0 108.64 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.33 -53.95 30.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 110.502 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.634 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 58.0 m -71.62 -45.09 63.11 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -0.868 . . . . 0.0 111.456 -177.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -67.67 -49.44 62.82 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.912 -1.117 . . . . 0.0 111.268 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -76.76 -23.79 52.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.995 -1.065 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.419 ' HG2' HD21 ' A' ' 116' ' ' LEU . 15.1 tptp -125.88 -30.96 2.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.81 -1.181 . . . . 0.0 111.416 -177.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 111' ' ' CYS . 15.3 t30 56.32 47.02 19.96 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.92 -1.113 . . . . 0.0 110.226 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.419 HD21 ' HG2' ' A' ' 114' ' ' LYS . 48.5 mt -67.64 -30.28 69.8 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.003 -1.06 . . . . 0.0 111.114 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 32.1 t -153.94 -166.64 2.43 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.371 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 64.0 p -126.79 153.66 75.92 Favored Pre-proline 0 N--CA 1.497 1.903 0 O-C-N 121.711 -0.618 . . . . 0.0 109.984 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -52.08 -40.54 68.05 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.121 1.881 . . . . 0.0 112.188 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.27 89.35 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.769 -1.207 . . . . 0.0 109.727 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -65.84 -42.94 89.86 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.6 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.1 tp -65.69 -53.59 38.92 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.576 -0.702 . . . . 0.0 109.937 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.629 ' HA ' HD12 ' A' ' 126' ' ' ILE . 68.3 tp60 -56.05 -44.37 78.78 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.55 75.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.54 -36.12 73.51 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.752 0.786 . . . . 0.0 108.954 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.712 HD11 ' CE ' ' A' ' 103' ' ' MET . 34.0 mt -59.05 -52.89 55.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -67.0 -37.7 84.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.509 -0.744 . . . . 0.0 109.327 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.15 -30.11 72.89 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.539 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 7.1 p30 -95.82 -36.36 11.16 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.916 -1.344 . . . . 0.0 110.505 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.539 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 55.7 mtp180 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 120.85 -1.156 . . . . 0.0 110.295 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.888 ' O ' HG12 ' A' ' 13' ' ' VAL . 6.3 mm100 . . . . . 0 N--CA 1.487 1.415 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -55.15 -49.4 71.92 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.363 -0.836 . . . . 0.0 109.62 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -61.6 -38.73 88.68 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.92 -1.113 . . . . 0.0 109.176 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -65.21 -52.56 53.94 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.482 -0.761 . . . . 0.0 111.13 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.888 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -70.53 -35.95 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.989 -1.069 . . . . 0.0 109.62 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -60.05 -38.73 83.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.305 -1.497 . . . . 0.0 107.894 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -58.93 -31.87 69.05 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.9 mt -67.44 -36.41 81.16 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.436 -0.79 . . . . 0.0 110.964 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.417 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 81.5 m-85 -82.32 -38.62 24.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.375 -1.453 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.6 -30.25 71.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.067 -1.021 . . . . 0.0 111.032 -177.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 16' ' ' LEU . 8.1 mt -38.02 -37.08 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 O-C-N 121.567 -0.708 . . . . 0.0 110.363 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.3 m120 -170.31 159.68 7.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.952 -1.093 . . . . 0.0 109.78 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.2 64.82 4.56 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.736 -0.603 . . . . 0.0 109.525 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.94 137.55 20.15 Favored Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -71.81 -61.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.029 1.819 . . . . 0.0 112.198 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -59.35 -37.84 78.89 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.224 -0.923 . . . . 0.0 109.649 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.482 ' NH2' HG21 ' A' ' 19' ' ' ILE . 57.0 ttt180 -56.84 -42.39 79.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.646 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -60.9 -54.23 47.65 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.154 -0.966 . . . . 0.0 108.834 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -53.42 -36.17 61.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.591 -0.693 . . . . 0.0 109.633 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -61.42 -62.91 1.49 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.344 -0.847 . . . . 0.0 110.816 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.632 HD22 HD13 ' A' ' 16' ' ' LEU . 16.4 mt -57.13 -44.45 83.36 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.515 -0.741 . . . . 0.0 109.55 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.417 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 30.6 m-20 -63.4 -45.9 88.9 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.352 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -66.43 -42.37 87.82 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.114 -0.991 . . . . 0.0 109.008 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.97 -50.51 73.15 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.322 -0.861 . . . . 0.0 110.169 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -60.83 -34.08 74.01 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 117.988 -1.485 . . . . 0.0 107.971 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.5 m -68.88 -50.16 52.06 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.092 -1.005 . . . . 0.0 108.942 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.1 -43.27 95.7 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 111.103 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.7 mmm -58.22 -35.79 72.18 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.229 -0.92 . . . . 0.0 110.84 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -59.19 -40.33 85.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.695 -1.253 . . . . 0.0 108.853 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -64.73 -40.91 96.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.332 -0.855 . . . . 0.0 109.396 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -65.2 -30.11 70.98 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.898 -0.501 . . . . 0.0 110.412 -178.758 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 1.13 64.63 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 107.775 -2.13 . . . . 0.0 107.775 -178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.4 p -116.56 85.23 16.22 Favored Pre-proline 0 N--CA 1.488 1.434 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -83.53 148.47 12.72 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.733 2.289 . . . . 0.0 111.716 -179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.622 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 46.0 mt -87.52 101.42 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.037 -1.039 . . . . 0.0 110.195 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.41 ' C ' ' OE1' ' A' ' 9' ' ' GLN . 84.9 m-20 -85.95 -0.77 56.31 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.311 -0.868 . . . . 0.0 109.026 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.6 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -171.79 120.23 0.46 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.507 -0.745 . . . . 0.0 109.206 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.53 HD23 HG21 ' A' ' 43' ' ' ILE . 14.0 mt -72.09 118.9 71.21 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.054 -1.029 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.438 ' HB3' ' NE2' ' A' ' 101' ' ' GLN . 48.3 Cg_exo -49.72 128.29 20.94 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 N-CA-C 108.831 -1.257 . . . . 0.0 108.831 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.502 HG23 ' N ' ' A' ' 52' ' ' SER . 60.4 mt -95.71 144.19 10.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.134 -0.979 . . . . 0.0 110.608 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.71 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.4 mtp -135.09 122.1 21.26 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.87 39.83 3.27 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -178.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 58.6 24.4 12.0 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.252 0.549 . . . . 0.0 110.247 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.502 ' N ' HG23 ' A' ' 48' ' ' ILE . 78.2 p -136.64 152.75 50.77 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.189 -0.945 . . . . 0.0 109.445 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.9 m -67.39 144.99 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 120.973 -1.079 . . . . 0.0 109.216 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.71 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.3 tp -74.16 120.49 19.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 110.028 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -63.05 91.8 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.341 -0.85 . . . . 0.0 109.09 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.06 -26.22 59.99 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.145 -0.972 . . . . 0.0 110.096 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.444 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 44.3 t80 -81.02 -57.03 3.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.066 -1.021 . . . . 0.0 111.586 -178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.43 -37.87 79.21 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.564 -1.335 . . . . 0.0 109.411 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.629 HD22 HD21 ' A' ' 54' ' ' LEU . 65.3 tp -59.83 -45.99 90.65 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CE2' HG13 ' A' ' 64' ' ' ILE . 43.3 t80 -57.26 -66.64 0.42 Allowed 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.522 0.677 . . . . 0.0 109.41 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 74.6 m-20 -41.43 -41.13 1.94 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.689 -0.632 . . . . 0.0 111.219 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.44 -43.14 64.2 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 118.234 -1.386 . . . . 0.0 107.689 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 43.7 t -59.39 -44.75 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.874 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.413 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -69.51 -36.86 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.663 -1.273 . . . . 0.0 108.318 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.403 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.1 -22.81 11.88 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.848 -0.533 . . . . 0.0 110.27 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.517 ' CG ' HD13 ' A' ' 77' ' ' LEU . 9.0 mpt_? -92.93 -0.22 57.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.614 -1.304 . . . . 0.0 108.753 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.98 17.99 68.55 Favored Glycine 0 N--CA 1.49 2.252 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.818 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 141.24 129.38 2.48 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 120.548 -1.56 . . . . 0.0 111.259 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.55 HD11 ' CH2' ' A' ' 78' ' ' TRP . 15.6 tp -50.36 -40.64 49.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.677 -0.896 . . . . 0.0 110.361 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.2 t -57.75 -42.14 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.861 -1.149 . . . . 0.0 109.871 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -55.94 -40.12 72.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.914 -1.116 . . . . 0.0 108.909 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 94.0 t -65.06 -41.29 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 110.157 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.47 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 49.3 mt -67.59 -56.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 O-C-N 120.775 -1.203 . . . . 0.0 109.734 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -57.69 -42.03 82.84 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.136 -0.977 . . . . 0.0 110.184 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -92.23 -10.21 39.38 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.253 -0.904 . . . . 0.0 110.452 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 3.5 mtmp? 58.54 59.08 3.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.385 -0.822 . . . . 0.0 110.05 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 15.37 11.46 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.014 -1.054 . . . . 0.0 108.545 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.734 ' HE1' HH12 ' A' ' 99' ' ' ARG . 99.0 m95 -63.26 -37.56 87.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 108.923 178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.419 ' C ' ' O ' ' A' ' 78' ' ' TRP . 1.1 mp0 -48.9 -40.82 31.35 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.439 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HB3' HH21 ' A' ' 66' ' ' ARG . 81.3 mm-40 -69.05 -38.85 79.34 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt -71.28 -53.46 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.718 HD11 ' HB2' ' A' ' 95' ' ' ALA . 76.3 mt -53.19 -52.83 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -73.58 -40.29 64.0 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.292 -0.88 . . . . 0.0 109.889 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.05 -34.18 46.06 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.7 mt -88.48 -7.2 56.94 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.287 -1.125 . . . . 0.0 108.886 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 7.2 m80 69.15 36.67 2.34 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.576 0.703 . . . . 0.0 109.245 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -73.3 121.01 84.06 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.359 -0.838 . . . . 0.0 109.198 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 90' ' ' SER . 45.9 Cg_exo -50.08 139.62 34.06 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.669 1.579 . . . . 0.0 112.23 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 p -63.44 0.87 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 109.619 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 88' ' ' PRO . 89.1 p -65.04 -24.49 67.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.935 -178.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 50' ' ' ALA . 86.6 mt -95.72 98.43 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.948 -1.095 . . . . 0.0 108.894 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 30.6 p -68.36 -28.51 67.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -0.92 . . . . 0.0 108.803 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.8 m -90.5 30.54 1.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.26 -65.9 0.62 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.855 . . . . 0.0 108.986 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.718 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.92 -50.7 33.95 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 109.179 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.03 -45.66 86.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.851 -1.156 . . . . 0.0 108.978 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.9 m -60.67 -40.02 90.56 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.174 -0.954 . . . . 0.0 108.845 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.5 mt -72.56 -44.49 62.02 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.452 -0.78 . . . . 0.0 110.152 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.734 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.6 ttm-85 -65.99 -52.86 45.65 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.176 -0.953 . . . . 0.0 110.739 -179.105 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.1 m -57.05 -52.73 64.11 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.43 -0.794 . . . . 0.0 110.778 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.438 ' NE2' ' HB3' ' A' ' 47' ' ' PRO . 86.6 mt-30 -62.34 -40.67 97.13 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.127 -0.983 . . . . 0.0 111.142 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.4 t80 -57.92 -39.49 78.1 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 120.55 -1.344 . . . . 0.0 109.038 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.538 ' HG3' HD21 ' A' ' 122' ' ' LEU . 2.9 ttm -53.96 -56.49 17.34 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.548 -0.72 . . . . 0.0 111.877 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -72.42 -52.18 17.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.479 -1.388 . . . . 0.0 113.032 -176.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.428 ' C ' HD12 ' A' ' 106' ' ' LEU . 62.6 m-85 -85.33 -50.96 6.9 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.629 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -96.52 6.05 49.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.338 -1.476 . . . . 0.0 113.751 -176.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.598 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 78.0 t80 -68.42 -37.15 9.83 Favored Pre-proline 0 C--N 1.3 -1.545 0 O-C-N 120.013 -1.68 . . . . 0.0 111.666 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.1 Cg_endo -80.28 -39.52 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.333 1.356 . . . . 0.0 111.688 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.47 -39.84 84.99 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -72.68 -53.91 10.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.482 -0.761 . . . . 0.0 109.909 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.59 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.8 t -70.56 -44.25 67.81 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.294 -0.879 . . . . 0.0 110.739 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.447 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 43.3 tp10 -66.79 -47.87 70.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 120.759 -1.213 . . . . 0.0 110.851 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -75.97 -28.17 57.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 111.158 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HG2' HD21 ' A' ' 116' ' ' LEU . 44.3 tptt -125.32 -26.55 3.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.064 -1.022 . . . . 0.0 111.811 -177.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 111' ' ' CYS . 48.3 t-20 57.72 45.67 18.5 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.644 -1.285 . . . . 0.0 110.048 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.462 HD21 ' HG2' ' A' ' 114' ' ' LYS . 75.6 mt -68.4 -32.61 72.79 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.203 -0.935 . . . . 0.0 110.958 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.505 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 42.9 t -155.79 -166.93 2.34 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.633 -1.227 . . . . 0.0 111.94 -178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.456 ' C ' ' OH ' ' A' ' 107' ' ' TYR . 70.5 p -120.55 153.65 56.53 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -179.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.598 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 14.7 Cg_endo -59.35 -38.17 86.09 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.876 1.717 . . . . 0.0 112.186 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.07 85.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.051 -1.031 . . . . 0.0 109.319 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.505 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.9 mt-10 -66.81 -42.73 85.4 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.538 HD21 ' HG3' ' A' ' 103' ' ' MET . 11.5 tp -64.74 -52.85 54.87 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 109.431 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -57.89 -46.43 84.92 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.201 -0.937 . . . . 0.0 109.065 178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.8 -42.72 98.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.38 -0.825 . . . . 0.0 110.152 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.53 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.061 -1.024 . . . . 0.0 108.342 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.523 ' HA ' ' ND2' ' A' ' 129' ' ' ASN . 4.1 mt -65.47 -49.25 79.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 130' ' ' ARG . 89.8 m-20 -61.09 -38.3 85.78 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.66 -30.87 78.1 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.523 ' ND2' ' HA ' ' A' ' 126' ' ' ILE . 3.6 p30 -90.59 -34.28 15.55 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.981 -1.305 . . . . 0.0 110.902 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.51 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 67.6 mtm180 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 120.625 -1.297 . . . . 0.0 109.513 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.818 ' O ' HG12 ' A' ' 13' ' ' VAL . 2.9 mm-40 . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.3 -49.57 66.72 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.88 . . . . 0.0 109.768 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -61.56 -37.61 84.47 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.162 -0.961 . . . . 0.0 109.275 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -65.77 -53.32 42.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.166 -0.959 . . . . 0.0 110.956 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.818 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -72.76 -36.16 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.995 -1.066 . . . . 0.0 109.707 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -60.99 -40.99 95.57 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.261 -1.524 . . . . 0.0 108.421 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -59.05 -30.73 68.26 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.231 -0.918 . . . . 0.0 108.733 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.63 ' HA ' HD12 ' A' ' 19' ' ' ILE . 12.0 mt -67.31 -33.88 76.19 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.922 178.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -83.96 -40.9 17.91 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.636 -1.29 . . . . 0.0 110.723 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.8 mm-40 -57.42 -32.23 66.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.054 -1.029 . . . . 0.0 109.322 -177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 16' ' ' LEU . 5.2 mt -44.62 -43.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 O-C-N 121.423 -0.798 . . . . 0.0 109.721 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 3.9 m120 -178.04 123.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.123 -0.986 . . . . 0.0 109.781 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.495 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 51.6 p30 -86.1 68.78 10.4 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.554 -0.716 . . . . 0.0 110.789 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.4 130.94 39.84 Favored Pre-proline 0 C--N 1.303 -1.414 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -40.08 -64.16 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 C-N-CA 122.118 1.879 . . . . 0.0 112.984 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -63.89 -39.26 93.78 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.705 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.547 ' NH2' HG21 ' A' ' 19' ' ' ILE . 58.7 ttt180 -59.78 -45.99 90.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.845 -1.16 . . . . 0.0 110.38 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -61.0 -47.46 86.34 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.829 -1.17 . . . . 0.0 108.697 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.514 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 84.9 tt0 -53.03 -27.68 20.8 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.389 0.614 . . . . 0.0 109.784 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -71.89 -61.68 1.7 Allowed 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.114 -0.991 . . . . 0.0 111.33 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 16' ' ' LEU . 13.6 mt -60.27 -44.68 95.11 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.383 -0.823 . . . . 0.0 111.057 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.589 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 40.9 p-10 -64.37 -46.02 85.17 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 118.931 -1.107 . . . . 0.0 109.579 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.589 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 52.5 t0 -65.74 -43.54 88.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.289 -0.882 . . . . 0.0 109.445 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -54.63 -49.09 71.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.188 -0.945 . . . . 0.0 109.578 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.522 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 51.5 m-85 -62.1 -34.62 76.67 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.75 -1.18 . . . . 0.0 107.856 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -69.3 -55.41 10.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.536 -0.728 . . . . 0.0 110.44 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 39.2 t80 -60.52 -38.3 83.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.282 -0.886 . . . . 0.0 110.929 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.4 mmm -60.15 -36.21 77.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.007 . . . . 0.0 110.946 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -57.91 -41.2 82.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.052 . . . . 0.0 110.335 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -65.01 -37.78 88.78 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.644 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -64.48 -30.11 71.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.837 -178.637 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.36 1.21 64.59 Favored Glycine 0 N--CA 1.482 1.742 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 41.9 p -114.43 84.3 9.5 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -85.11 143.16 9.01 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.514 2.143 . . . . 0.0 110.767 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 46' ' ' LEU . 53.5 mt -80.68 99.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 120.944 -1.098 . . . . 0.0 110.008 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 80.9 m-20 -64.48 -46.83 81.35 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -138.22 133.2 32.9 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 43' ' ' ILE . 9.5 mt -70.69 147.47 94.5 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 120.84 -1.163 . . . . 0.0 109.182 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.33 106.64 1.8 Allowed 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 121.556 1.504 . . . . 0.0 109.875 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.524 HG23 ' N ' ' A' ' 52' ' ' SER . 40.6 mt -77.15 142.55 14.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.131 -0.98 . . . . 0.0 109.947 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.746 ' SD ' HG21 ' A' ' 97' ' ' THR . 69.0 mmm -134.08 127.08 31.45 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 59.87 42.6 16.17 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 59.65 25.61 14.57 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.205 0.526 . . . . 0.0 110.409 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.524 ' N ' HG23 ' A' ' 48' ' ' ILE . 95.3 p -138.02 153.53 49.37 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.129 -0.982 . . . . 0.0 109.758 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.2 m -66.88 145.07 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.027 -1.046 . . . . 0.0 109.178 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 HD22 ' A' ' 59' ' ' LEU . 46.1 tp -79.7 125.31 29.48 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.366 -0.834 . . . . 0.0 109.999 -179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.555 ' OD1' HD13 ' A' ' 19' ' ' ILE . 84.1 m-20 -68.35 89.6 0.34 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.404 -0.81 . . . . 0.0 109.301 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -52.03 -22.68 4.27 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.313 -0.867 . . . . 0.0 109.595 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.545 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 48.7 t80 -77.72 -55.38 5.39 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.06 -1.025 . . . . 0.0 111.66 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -61.81 -39.94 93.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.765 -1.209 . . . . 0.0 110.44 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.49 HD13 HD22 ' A' ' 98' ' ' LEU . 52.6 tp -59.55 -43.45 93.52 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 120.732 -1.23 . . . . 0.0 108.263 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.435 ' CE2' HG13 ' A' ' 64' ' ' ILE . 50.2 t80 -59.29 -66.75 0.46 Allowed 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.484 0.659 . . . . 0.0 109.653 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 71.8 m-20 -42.54 -39.48 2.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.61 -0.681 . . . . 0.0 110.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.47 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.6 mt -72.5 -44.74 61.84 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.448 -1.301 . . . . 0.0 107.851 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.8 t -58.8 -45.49 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.135 -0.978 . . . . 0.0 110.16 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.435 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.7 mm -67.72 -35.5 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.681 -1.262 . . . . 0.0 108.412 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.481 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.85 -25.15 26.79 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 120.261 -0.575 . . . . 0.0 110.073 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.586 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.8 mpt_? -91.17 -2.79 57.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.574 -1.329 . . . . 0.0 108.953 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.74 18.72 61.1 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.14 178.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.417 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 137.68 133.6 3.15 Favored Glycine 0 N--CA 1.501 3.031 0 CA-C-N 119.297 1.548 . . . . 0.0 111.41 178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' HH2' ' A' ' 78' ' ' TRP . 11.9 tp -51.13 -39.01 55.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.727 -0.866 . . . . 0.0 110.305 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.94 -43.3 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.037 -1.04 . . . . 0.0 109.543 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -58.05 -39.57 78.8 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.991 -1.068 . . . . 0.0 110.171 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 76' ' ' LYS . 52.2 t -64.13 -43.58 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.38 -0.825 . . . . 0.0 110.291 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.403 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 80.8 mt -66.03 -57.92 8.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 O-C-N 120.655 -1.278 . . . . 0.0 110.249 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -58.26 -41.34 84.05 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.174 -0.954 . . . . 0.0 110.415 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -92.61 -9.09 42.29 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.144 -0.973 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.0 mttp 57.67 57.3 4.34 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 -178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.539 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.7 mt -90.71 15.48 11.0 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 120.951 -1.093 . . . . 0.0 108.244 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.611 ' HH2' HD11 ' A' ' 69' ' ' LEU . 91.4 m95 -65.69 -40.27 92.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.5 -0.75 . . . . 0.0 109.121 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.607 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 5.4 mp0 -49.11 -38.71 25.63 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.389 -1.324 . . . . 0.0 108.16 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.586 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.7 mt-10 -69.76 -41.27 75.39 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.21 -52.69 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 95' ' ' ALA . 72.0 mt -50.95 -56.57 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.557 -0.714 . . . . 0.0 109.139 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -70.22 -37.23 74.99 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.169 -0.957 . . . . 0.0 110.087 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.95 -32.73 34.94 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.0 mt -92.21 -7.07 49.32 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.365 -1.08 . . . . 0.0 109.135 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.8 m80 68.09 40.97 2.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.746 -0.596 . . . . 0.0 110.122 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.27 140.45 85.21 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.102 -0.999 . . . . 0.0 108.844 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.557 ' C ' ' H ' ' A' ' 90' ' ' SER . 44.3 Cg_endo -70.69 141.57 41.76 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 122.181 1.92 . . . . 0.0 112.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.8 p -55.83 -0.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.399 -0.813 . . . . 0.0 109.845 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.557 ' H ' ' C ' ' A' ' 88' ' ' PRO . 84.4 p -66.51 -26.82 67.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.168 -0.958 . . . . 0.0 109.947 -178.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.422 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.3 mt -98.68 102.93 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.86 -1.15 . . . . 0.0 109.353 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.3 p -74.73 -27.79 60.51 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.044 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.5 m -94.2 37.82 1.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.475 -0.766 . . . . 0.0 109.196 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.69 -65.09 0.74 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.32 -0.862 . . . . 0.0 108.903 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.641 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.62 -51.7 20.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -0.894 . . . . 0.0 109.619 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.479 ' O ' ' OG1' ' A' ' 100' ' ' THR . 5.8 tp -58.73 -43.89 90.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.934 -1.104 . . . . 0.0 109.173 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.746 HG21 ' SD ' ' A' ' 49' ' ' MET . 10.6 m -62.69 -41.22 99.0 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.036 -1.04 . . . . 0.0 108.827 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.49 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -67.61 -43.08 81.31 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.428 -0.795 . . . . 0.0 109.509 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.707 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.7 ttm180 -68.62 -51.45 42.13 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.338 -0.851 . . . . 0.0 111.291 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.2 m -55.17 -52.32 63.69 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.195 -0.941 . . . . 0.0 110.009 -178.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -62.87 -42.09 99.63 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.201 -0.937 . . . . 0.0 111.377 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.6 t80 -58.55 -42.23 87.41 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.453 -1.404 . . . . 0.0 110.074 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.569 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.2 ttm -53.36 -54.79 31.46 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.377 -0.827 . . . . 0.0 111.253 -178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -73.45 -54.71 7.61 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.936 -1.102 . . . . 0.0 113.068 -176.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.413 ' C ' HD12 ' A' ' 106' ' ' LEU . 51.9 m-85 -84.07 -46.39 12.03 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.679 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.1 mp -96.02 -5.9 40.02 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.189 -1.569 . . . . 0.0 113.631 -176.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.641 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 83.2 t80 -59.89 -37.01 44.65 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 119.966 -1.708 . . . . 0.0 110.123 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.637 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 13.4 Cg_exo -69.03 -52.86 0.35 Allowed 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.378 2.052 . . . . 0.0 112.501 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -59.91 -42.52 94.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.408 -0.807 . . . . 0.0 109.587 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -69.42 -51.53 35.52 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.35 -0.844 . . . . 0.0 110.324 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 71.4 m -70.8 -42.36 70.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.348 -0.845 . . . . 0.0 110.49 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -66.81 -51.48 55.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.837 -1.164 . . . . 0.0 111.149 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -74.28 -26.12 60.01 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.035 -1.04 . . . . 0.0 111.408 -178.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.485 ' HG2' HD21 ' A' ' 116' ' ' LEU . 38.5 tptt -125.76 -29.73 3.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.977 -1.077 . . . . 0.0 111.607 -177.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.554 ' N ' ' O ' ' A' ' 111' ' ' CYS . 37.4 t30 55.96 45.82 23.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.685 -1.259 . . . . 0.0 109.885 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.485 HD21 ' HG2' ' A' ' 114' ' ' LYS . 53.3 mt -66.77 -33.14 74.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.267 -0.895 . . . . 0.0 111.174 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.496 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 10.7 t -155.57 -161.09 1.11 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 118.893 -1.123 . . . . 0.0 111.341 -178.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 71.1 p -125.53 164.22 33.85 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.738 -0.601 . . . . 0.0 109.66 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.495 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 16.5 Cg_exo -64.54 -36.14 44.63 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.549 1.499 . . . . 0.0 111.873 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.29 82.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.098 -1.001 . . . . 0.0 109.356 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 48.3 mt-10 -67.33 -45.22 77.06 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.569 HD21 ' HG3' ' A' ' 103' ' ' MET . 14.7 tp -66.2 -50.87 62.38 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.486 -0.759 . . . . 0.0 109.501 178.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -59.05 -46.17 88.9 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.098 -1.001 . . . . 0.0 109.311 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.73 97.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.373 -0.829 . . . . 0.0 110.381 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.69 73.63 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.508 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.1 mt -66.63 -51.16 59.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.08 -39.52 94.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.467 -0.77 . . . . 0.0 109.791 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -30.56 72.16 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.707 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 28.6 p30 -89.57 -24.99 21.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.335 -1.097 . . . . 0.0 110.299 -178.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.645 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.998 -1.064 . . . . 0.0 109.595 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.887 ' O ' HG12 ' A' ' 13' ' ' VAL . 33.0 mt-30 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.152 0.501 . . . . 0.0 109.81 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -48.56 -49.28 37.19 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 109.791 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -61.76 -40.04 93.75 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.418 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -67.42 -53.24 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.368 -0.833 . . . . 0.0 111.549 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.887 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.1 p -69.69 -38.72 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.038 -1.039 . . . . 0.0 110.197 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -60.72 -39.28 88.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.125 -1.61 . . . . 0.0 108.258 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -58.31 -29.44 65.89 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.229 -0.92 . . . . 0.0 108.68 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 46' ' ' LEU . 9.6 mt -69.75 -40.22 76.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.44 -0.787 . . . . 0.0 111.464 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.454 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 91.4 m-85 -75.22 -36.83 61.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.402 -1.436 . . . . 0.0 109.864 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.481 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -62.32 -28.13 69.52 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 110.81 -177.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.634 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.3 mt -37.43 -41.42 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 O-C-N 121.602 -0.686 . . . . 0.0 110.738 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -172.82 168.18 5.08 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.733 -1.229 . . . . 0.0 110.598 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -90.97 65.5 5.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.614 -0.678 . . . . 0.0 110.526 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.65 137.3 20.21 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.201 -0.937 . . . . 0.0 108.563 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.88 -61.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.078 1.852 . . . . 0.0 112.262 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -34.89 71.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.132 -0.98 . . . . 0.0 109.581 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.634 ' NH2' HD13 ' A' ' 19' ' ' ILE . 59.6 ttt180 -58.48 -42.22 87.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.179 -0.95 . . . . 0.0 110.166 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -60.29 -53.29 59.36 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.86 -1.136 . . . . 0.0 108.482 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.22 -35.55 60.05 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.567 -0.708 . . . . 0.0 109.244 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -64.45 -61.84 1.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.448 -0.783 . . . . 0.0 110.995 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 16' ' ' LEU . 70.7 mt -55.07 -46.96 75.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.915 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.454 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 39.1 m-20 -62.65 -46.64 87.29 Favored 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.492 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -67.17 -43.59 81.86 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.018 -1.051 . . . . 0.0 109.448 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.9 tp -56.32 -50.59 71.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 -179.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -61.78 -34.13 75.32 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.108 -1.437 . . . . 0.0 107.709 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.4 m -69.51 -53.02 21.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 109.553 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.419 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 60.0 t80 -59.14 -44.0 92.05 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.499 -0.751 . . . . 0.0 110.304 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 73.4 mmm -59.03 -37.46 77.03 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.666 -0.646 . . . . 0.0 110.462 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -59.39 -41.53 89.59 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.095 -1.003 . . . . 0.0 109.97 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.62 -46.34 79.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.511 HH11 ' HB2' ' A' ' 108' ' ' PRO . 2.8 mtp180 -62.59 -23.68 67.16 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.336 -0.852 . . . . 0.0 110.719 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.41 2.08 60.45 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 68.2 p -117.24 83.36 15.72 Favored Pre-proline 0 N--CA 1.493 1.693 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -86.98 145.62 7.58 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.987 2.458 . . . . 0.0 111.7 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD23 ' A' ' 46' ' ' LEU . 47.6 mt -79.86 98.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.082 -1.011 . . . . 0.0 109.142 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -63.14 -45.14 93.35 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -138.51 134.91 34.53 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.596 HD23 HG21 ' A' ' 43' ' ' ILE . 12.0 mt -70.93 144.62 90.64 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.816 -1.178 . . . . 0.0 109.463 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.78 116.29 4.66 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 121.587 1.524 . . . . 0.0 109.425 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.494 HG23 ' N ' ' A' ' 52' ' ' SER . 52.7 mt -82.59 144.19 10.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.001 -1.062 . . . . 0.0 110.061 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 46.9 mmm -139.59 124.97 19.06 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.7 41.06 3.09 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -177.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.3 mttm 59.16 22.69 10.89 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.342 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.494 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -140.02 157.43 45.68 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.987 -1.071 . . . . 0.0 110.133 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.7 m -66.73 144.3 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 120.964 -1.085 . . . . 0.0 109.019 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.559 HD21 HD22 ' A' ' 59' ' ' LEU . 44.0 tp -78.63 124.07 27.79 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.364 -0.835 . . . . 0.0 109.767 -179.008 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.515 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.0 m-20 -65.74 90.68 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.441 -0.787 . . . . 0.0 109.246 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 mt -55.44 -23.85 27.53 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.075 -1.016 . . . . 0.0 109.186 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -80.31 -57.94 3.37 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.179 -0.951 . . . . 0.0 111.58 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.7 -38.78 79.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.55 -1.344 . . . . 0.0 108.88 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.559 HD22 HD21 ' A' ' 54' ' ' LEU . 53.7 tp -58.18 -46.2 86.16 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.429 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.5 t80 -59.45 -66.18 0.55 Allowed 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.453 0.644 . . . . 0.0 109.303 178.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -42.04 -40.77 2.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.508 -0.745 . . . . 0.0 110.571 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.1 mt -71.69 -45.73 60.97 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.011 -1.476 . . . . 0.0 107.797 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.809 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.3 t -56.18 -45.07 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.137 -0.977 . . . . 0.0 110.253 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.429 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.7 mm -67.99 -35.98 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.665 -1.272 . . . . 0.0 107.894 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.31 -20.79 45.93 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 21.2 mmt-85 -93.88 0.81 56.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.579 -1.326 . . . . 0.0 108.443 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.39 13.62 73.12 Favored Glycine 0 N--CA 1.492 2.395 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.981 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.42 135.92 3.42 Favored Glycine 0 N--CA 1.502 3.058 0 CA-C-N 119.366 1.583 . . . . 0.0 111.391 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' CH2' ' A' ' 78' ' ' TRP . 11.0 tp -52.42 -39.62 61.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.553 -0.969 . . . . 0.0 110.374 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.506 HG22 ' HA ' ' A' ' 122' ' ' LEU . 85.3 t -58.74 -45.1 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.02 -1.05 . . . . 0.0 109.772 -178.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.33 -39.16 69.65 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.029 -1.045 . . . . 0.0 108.651 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.8 t -63.94 -41.23 91.84 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.506 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.403 HG12 ' NH1' ' A' ' 99' ' ' ARG . 64.0 mt -66.96 -61.86 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 O-C-N 120.82 -1.175 . . . . 0.0 110.384 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -57.73 -40.16 78.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.192 -0.942 . . . . 0.0 110.215 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -91.61 -11.63 36.6 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.172 -0.955 . . . . 0.0 110.685 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.1 mtmt 58.73 60.11 2.64 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -178.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -94.63 14.44 21.03 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.935 -1.103 . . . . 0.0 108.773 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.611 ' CH2' HD11 ' A' ' 69' ' ' LEU . 81.6 m95 -62.97 -39.52 94.95 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.124 -0.985 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 78' ' ' TRP . 95.4 mm-40 -48.85 -39.39 25.46 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.379 -1.451 . . . . 0.0 108.371 178.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 79.0 mm-40 -66.25 -39.93 89.84 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.406 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -73.67 -50.55 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.553 -0.717 . . . . 0.0 109.211 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.781 HD11 ' HB2' ' A' ' 95' ' ' ALA . 79.7 mt -51.8 -54.02 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.509 -0.744 . . . . 0.0 109.5 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.41 -38.9 68.28 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.037 -1.04 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.74 -32.37 40.04 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.3 mt -90.47 -7.05 54.03 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.393 -1.063 . . . . 0.0 109.156 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 65.85 40.44 4.22 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.838 -0.539 . . . . 0.0 110.633 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.73 141.5 82.37 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 108.483 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.553 ' C ' ' H ' ' A' ' 90' ' ' SER . 57.6 Cg_endo -73.32 143.66 35.53 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.055 1.837 . . . . 0.0 112.532 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.7 m -58.06 1.42 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.356 -0.84 . . . . 0.0 109.664 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.553 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.6 p -66.57 -24.56 66.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.186 -0.947 . . . . 0.0 109.966 -178.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.544 HD11 ' H ' ' A' ' 50' ' ' ALA . 81.6 mt -103.06 107.09 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 120.989 -1.069 . . . . 0.0 109.412 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.3 p -76.48 -28.15 56.36 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 108.729 179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 m -90.26 30.95 1.04 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.531 -0.731 . . . . 0.0 109.36 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.24 -64.74 0.85 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.781 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.57 -52.73 36.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 0.0 109.409 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.96 -44.71 91.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.825 -1.172 . . . . 0.0 108.884 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.1 m -59.06 -40.87 86.46 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 59' ' ' LEU . 13.9 mt -68.75 -42.23 77.83 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.616 -0.678 . . . . 0.0 109.266 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.465 ' HG3' HH11 ' A' ' 99' ' ' ARG . 11.1 ttm-85 -65.05 -52.37 56.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.123 -0.986 . . . . 0.0 110.415 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.5 m -57.32 -53.65 55.67 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.429 -0.794 . . . . 0.0 110.341 -178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -64.79 -44.53 89.67 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.831 -1.168 . . . . 0.0 112.178 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.7 t80 -57.91 -40.12 79.62 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.087 -1.633 . . . . 0.0 108.783 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' MET . . . . . 1.013 ' SD ' HD21 ' A' ' 122' ' ' LEU . 55.8 mmm -52.55 -58.86 5.43 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.67 -0.644 . . . . 0.0 111.909 -179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -73.76 -50.8 18.89 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.559 -1.338 . . . . 0.0 112.818 -176.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.468 ' C ' HD12 ' A' ' 106' ' ' LEU . 63.8 m-85 -83.97 -48.53 9.86 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.031 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.9 mp -99.39 6.04 46.18 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.255 -1.528 . . . . 0.0 113.819 -176.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.528 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 36.0 t80 -66.58 -38.84 21.27 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.042 -1.661 . . . . 0.0 111.09 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.2 Cg_endo -78.64 -41.55 0.25 Allowed 'Trans proline' 0 N--CA 1.487 1.145 0 C-N-CA 121.472 1.448 . . . . 0.0 112.568 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.78 -42.62 89.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.85 -1.156 . . . . 0.0 108.348 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.96 -43.56 62.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.436 -0.79 . . . . 0.0 110.035 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.586 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.8 t -79.95 -46.27 17.01 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.1 -1.0 . . . . 0.0 110.927 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.8 tp10 -66.34 -45.62 79.6 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.737 -1.227 . . . . 0.0 110.634 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -75.34 -35.37 61.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.115 -0.99 . . . . 0.0 110.965 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.1 tptp -118.39 -27.15 6.06 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.012 -1.055 . . . . 0.0 111.876 -177.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 111' ' ' CYS . 36.6 t-20 55.08 45.48 26.11 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.748 -1.22 . . . . 0.0 110.474 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.2 mt -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.105 -0.997 . . . . 0.0 110.561 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.477 ' OG ' ' N ' ' A' ' 118' ' ' THR . 37.8 t -153.02 -167.03 2.61 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.153 -1.019 . . . . 0.0 111.056 -178.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.477 ' N ' ' OG ' ' A' ' 117' ' ' SER . 65.5 p -127.32 159.12 67.02 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.574 -0.704 . . . . 0.0 110.171 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -55.97 -41.94 71.89 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.691 1.594 . . . . 0.0 112.665 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.6 91.81 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.878 -1.139 . . . . 0.0 109.754 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.55 -44.37 82.51 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.013 HD21 ' SD ' ' A' ' 103' ' ' MET . 15.2 tp -66.55 -52.41 45.93 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.664 -0.648 . . . . 0.0 110.251 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -57.64 -46.18 84.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.055 -1.028 . . . . 0.0 109.554 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.78 87.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.85 -34.55 76.92 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.285 -0.885 . . . . 0.0 108.75 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.556 HD11 ' SD ' ' A' ' 103' ' ' MET . 10.4 mt -66.25 -49.09 78.59 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -61.68 -38.24 87.07 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.069 -1.019 . . . . 0.0 108.709 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.59 -28.71 73.57 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.9 p-10 -89.92 -30.19 18.02 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.694 -1.474 . . . . 0.0 110.335 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.655 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 O-C-N 120.886 -1.134 . . . . 0.0 109.123 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.639 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 11.4 mm100 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 121.268 0.556 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.01 -49.76 65.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.975 -1.078 . . . . 0.0 109.649 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -62.19 -42.14 99.0 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.172 -0.955 . . . . 0.0 109.336 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.41 ' C ' HD11 ' A' ' 46' ' ' LEU . 18.0 mm100 -65.27 -49.76 68.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.58 -0.7 . . . . 0.0 110.805 -179.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.41 HG13 ' O ' ' A' ' 9' ' ' GLN . 4.1 m -71.74 -35.99 57.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 120.692 -1.255 . . . . 0.0 108.641 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.494 ' O ' ' OE1' ' A' ' 18' ' ' GLU . 6.9 tpt180 -54.56 -40.81 69.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.614 -1.304 . . . . 0.0 107.532 178.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -58.49 -31.4 67.81 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.452 ' HA ' HD12 ' A' ' 19' ' ' ILE . 10.2 mt -72.63 -37.34 68.06 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.433 -0.792 . . . . 0.0 111.469 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -77.49 -33.13 54.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.364 -1.46 . . . . 0.0 110.009 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.503 ' O ' ' C ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -69.48 -27.86 65.58 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.088 -1.007 . . . . 0.0 111.282 -177.771 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.503 ' C ' ' O ' ' A' ' 18' ' ' GLU . 19.3 mt -35.74 -38.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.672 -0.642 . . . . 0.0 110.161 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLU . 11.3 p30 -173.56 168.24 4.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.071 -1.018 . . . . 0.0 110.153 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -90.86 74.43 6.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.656 -0.653 . . . . 0.0 110.044 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -108.82 134.36 20.36 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.7 -59.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 122.079 1.853 . . . . 0.0 112.305 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -58.66 -34.18 70.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.616 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.692 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -57.09 -42.12 80.16 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.016 -1.052 . . . . 0.0 109.384 -179.613 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -61.4 -54.27 45.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.903 -1.123 . . . . 0.0 108.707 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -52.97 -37.24 61.02 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -62.47 -62.57 1.66 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.48 -0.763 . . . . 0.0 109.854 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.514 HD21 HH12 ' A' ' 25' ' ' ARG . 82.0 mt -54.8 -46.34 74.47 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 121.528 0.68 . . . . 0.0 109.72 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.4 -49.65 76.01 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.003 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -66.54 -43.62 84.64 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.179 -0.95 . . . . 0.0 110.197 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.33 -52.12 64.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.967 . . . . 0.0 110.416 -178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.448 ' CE1' HD12 ' A' ' 43' ' ' ILE . 43.9 m-85 -62.48 -32.63 73.56 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.771 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 t -67.51 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 111.311 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.597 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -63.6 -27.32 69.16 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 111.232 -178.422 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.0 mmm -64.13 -39.55 94.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.934 -1.104 . . . . 0.0 111.057 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.09 -36.39 81.56 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.939 -1.101 . . . . 0.0 110.524 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -59.4 -50.09 75.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.211 -0.931 . . . . 0.0 111.065 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB3' ' A' ' 108' ' ' PRO . 28.5 mtp180 -64.19 -19.78 65.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.807 -178.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.91 3.47 55.91 Favored Glycine 0 N--CA 1.482 1.718 0 N-CA-C 108.187 -1.965 . . . . 0.0 108.187 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.1 p -117.42 83.99 17.58 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.587 -0.949 . . . . 0.0 108.943 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.66 150.36 2.3 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 123.441 2.76 . . . . 0.0 111.755 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.639 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 55.7 mt -84.87 98.19 5.96 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 120.865 -1.147 . . . . 0.0 109.153 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -79.65 -12.95 59.8 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.466 ' CG ' ' O ' ' A' ' 45' ' ' ARG . 0.5 OUTLIER -159.4 122.93 3.72 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 43' ' ' ILE . 3.6 mt -71.46 147.1 92.41 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 120.728 -1.232 . . . . 0.0 109.349 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.82 138.14 40.15 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 121.279 1.319 . . . . 0.0 108.967 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 52' ' ' SER . 6.6 mt -105.64 146.08 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 120.9 -1.125 . . . . 0.0 110.17 -178.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.669 ' SD ' HD13 ' A' ' 54' ' ' LEU . 77.9 mtp -143.26 122.37 12.9 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.47 39.8 1.54 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 72.6 mttt 58.15 24.49 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.478 0.656 . . . . 0.0 109.654 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' HG23 ' A' ' 48' ' ' ILE . 85.8 p -138.31 157.3 46.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.533 -0.729 . . . . 0.0 109.153 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -69.54 149.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.965 -1.084 . . . . 0.0 109.472 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.68 HD21 HD22 ' A' ' 59' ' ' LEU . 59.1 tp -82.12 124.24 29.68 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.378 -0.826 . . . . 0.0 109.741 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.41 92.94 0.07 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.592 -0.693 . . . . 0.0 110.065 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -54.34 -26.21 28.57 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 120.821 -1.174 . . . . 0.0 109.318 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -78.4 -62.6 1.63 Allowed 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.951 . . . . 0.0 111.584 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.68 -36.65 67.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.685 -1.259 . . . . 0.0 109.458 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.68 HD22 HD21 ' A' ' 54' ' ' LEU . 54.6 tp -61.07 -45.63 93.97 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 178.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.456 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.8 t80 -61.83 -68.13 0.35 Allowed 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.296 0.569 . . . . 0.0 109.506 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.431 ' C ' ' O ' ' A' ' 60' ' ' TYR . 57.3 t30 -42.57 -36.98 1.52 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.405 -0.809 . . . . 0.0 109.567 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.625 HD13 ' HA ' ' A' ' 81' ' ' ILE . 8.0 mt -70.42 -50.86 34.14 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.031 -1.043 . . . . 0.0 108.448 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.866 HG21 ' CE2' ' A' ' 102' ' ' TYR . 42.3 t -58.05 -42.59 83.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.097 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.456 HG13 ' CE2' ' A' ' 60' ' ' TYR . 11.2 mm -70.14 -34.82 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.572 -1.33 . . . . 0.0 108.151 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.445 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.33 -24.1 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.735 -0.603 . . . . 0.0 110.724 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.515 ' CG ' HD13 ' A' ' 77' ' ' LEU . 8.0 mpt_? -94.14 3.72 54.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.622 -1.298 . . . . 0.0 109.564 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 16.21 69.99 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.251 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.92 134.89 3.38 Favored Glycine 0 N--CA 1.501 2.995 0 O-C-N 120.502 -1.587 . . . . 0.0 111.424 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.636 HD11 ' CH2' ' A' ' 78' ' ' TRP . 16.1 tp -52.74 -40.18 62.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.644 -0.916 . . . . 0.0 110.863 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.565 HG11 ' HB3' ' A' ' 121' ' ' GLU . 58.6 t -57.05 -42.98 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.893 -1.129 . . . . 0.0 109.318 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -57.56 -40.39 78.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.918 -1.113 . . . . 0.0 109.538 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 78.8 t -64.69 -43.19 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.376 -0.828 . . . . 0.0 110.271 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.426 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 61.1 mt -66.33 -55.4 18.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 O-C-N 120.878 -1.139 . . . . 0.0 110.273 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.5 m-20 -57.63 -42.39 83.3 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.159 -0.963 . . . . 0.0 110.266 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -93.58 -9.4 38.27 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.196 -0.94 . . . . 0.0 110.643 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 27.2 mtmm 58.56 60.17 2.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.409 -0.807 . . . . 0.0 109.849 -178.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 14.94 12.34 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.636 ' CH2' HD11 ' A' ' 69' ' ' LEU . 99.0 m95 -61.27 -40.86 95.68 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.5 mt-30 -47.22 -39.9 15.1 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.748 -1.22 . . . . 0.0 108.673 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' ' NH2' ' A' ' 66' ' ' ARG . 76.5 mm-40 -68.54 -41.68 79.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.625 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.2 mt -69.5 -52.85 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 95' ' ' ALA . 50.5 mt -53.98 -55.34 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.607 -0.683 . . . . 0.0 109.448 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 86' ' ' HIS . 68.5 mttt -68.4 -42.27 79.27 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.336 -0.853 . . . . 0.0 109.869 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.16 -31.36 26.29 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.3 mt -91.15 -7.45 51.46 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.463 -1.022 . . . . 0.0 109.037 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 83' ' ' LYS . 71.3 m-70 62.8 42.32 8.06 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.837 -0.539 . . . . 0.0 110.124 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.7 mt -71.95 137.61 82.28 Favored Pre-proline 0 N--CA 1.488 1.453 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.586 ' C ' ' H ' ' A' ' 90' ' ' SER . 31.6 Cg_endo -66.9 141.57 59.23 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.892 1.728 . . . . 0.0 112.264 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 32.5 m -55.82 1.26 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.201 -0.937 . . . . 0.0 109.995 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.586 ' H ' ' C ' ' A' ' 88' ' ' PRO . 85.4 p -65.89 -25.35 67.13 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.099 -1.001 . . . . 0.0 109.805 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.549 HD11 ' H ' ' A' ' 50' ' ' ALA . 74.1 mt -100.47 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.064 -1.023 . . . . 0.0 109.205 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.4 p -76.98 -23.32 52.3 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.178 -0.951 . . . . 0.0 109.164 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.1 m -100.25 39.27 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.448 -0.783 . . . . 0.0 109.067 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.55 -63.75 1.05 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.87 . . . . 0.0 109.294 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.55 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.23 -51.53 14.19 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.21 -0.932 . . . . 0.0 109.612 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -59.01 -43.32 91.53 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.774 -1.204 . . . . 0.0 108.895 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 63.6 m -60.92 -41.24 95.77 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.992 -1.067 . . . . 0.0 108.531 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 95' ' ' ALA . 10.4 mt -70.19 -44.11 69.37 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.498 -0.751 . . . . 0.0 109.841 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.569 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.3 ttm-85 -67.0 -53.37 32.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.292 -0.88 . . . . 0.0 110.925 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 m -55.0 -50.06 69.95 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.029 -1.044 . . . . 0.0 109.335 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -64.2 -43.87 93.72 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.145 -0.972 . . . . 0.0 111.624 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.866 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.35 -41.42 84.64 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.422 -1.424 . . . . 0.0 109.183 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.761 ' HG2' HD21 ' A' ' 122' ' ' LEU . 81.5 mtp -50.91 -56.48 12.1 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.584 -0.697 . . . . 0.0 111.431 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.0 mttt -73.58 -55.92 5.69 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.933 -1.104 . . . . 0.0 113.15 -176.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' LEU . 56.2 m-85 -84.24 -46.4 11.87 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 115.4 1.629 . . . . 0.0 115.4 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 106' ' ' LEU . 5.8 mp -97.6 -4.87 36.75 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.212 -1.555 . . . . 0.0 113.177 -176.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 39.2 t80 -62.81 -36.65 27.3 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 120.074 -1.641 . . . . 0.0 109.466 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.6 Cg_exo -66.17 -52.74 0.79 Allowed 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 122.15 1.9 . . . . 0.0 111.678 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.29 -48.46 80.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.292 -0.88 . . . . 0.0 109.504 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.49 -47.77 69.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.118 -0.989 . . . . 0.0 110.368 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.6 t -73.99 -46.36 44.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.984 -1.073 . . . . 0.0 110.719 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.597 ' OE1' ' CZ ' ' A' ' 35' ' ' PHE . 35.2 tt0 -66.88 -51.89 50.0 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 120.904 -1.122 . . . . 0.0 111.304 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -74.57 -32.39 62.38 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.119 -0.988 . . . . 0.0 111.874 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.41 ' HG2' HD21 ' A' ' 116' ' ' LEU . 35.4 tptt -117.25 -29.69 5.82 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.895 -1.128 . . . . 0.0 111.616 -177.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 111' ' ' CYS . 19.0 t-20 54.83 44.78 27.88 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.683 -1.261 . . . . 0.0 110.481 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.41 HD21 ' HG2' ' A' ' 114' ' ' LYS . 74.7 mt -67.36 -28.33 67.86 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.992 -1.068 . . . . 0.0 110.903 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 118' ' ' THR . 4.5 t -153.61 -168.17 2.91 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.273 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.597 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.1 p -122.8 152.5 62.51 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.53 -178.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.415 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 9.5 Cg_endo -55.02 -36.76 93.45 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 C-N-CA 122.042 1.828 . . . . 0.0 112.08 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.33 83.24 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.943 -1.098 . . . . 0.0 109.243 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.565 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.7 mt-10 -65.93 -44.49 84.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 177.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 103' ' ' MET . 33.0 tp -63.56 -51.79 63.85 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.727 -0.608 . . . . 0.0 109.445 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -58.01 -50.13 74.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.241 -0.912 . . . . 0.0 109.658 178.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.24 -41.4 96.83 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.41 -0.806 . . . . 0.0 110.209 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.469 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.22 -33.57 74.66 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 103' ' ' MET . 5.5 mt -63.46 -49.78 81.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.97 -36.96 82.99 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.23 -32.98 78.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 12.4 p30 -92.59 -29.47 16.13 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.016 -1.285 . . . . 0.0 110.366 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.618 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.088 -1.007 . . . . 0.0 109.855 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.866 ' O ' HG12 ' A' ' 13' ' ' VAL . 45.6 mt-30 . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.83 -47.66 51.36 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.334 -0.854 . . . . 0.0 109.052 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -62.29 -41.56 98.6 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.156 -0.965 . . . . 0.0 109.6 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -65.78 -51.14 61.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.948 . . . . 0.0 110.47 -179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.866 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.3 p -70.92 -37.05 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 120.989 -1.07 . . . . 0.0 109.845 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.608 HH11 ' CG ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -61.39 -38.37 86.82 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 119.926 -1.734 . . . . 0.0 108.03 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.17 -30.23 66.24 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.466 HD11 HD22 ' A' ' 46' ' ' LEU . 13.4 mt -69.37 -39.55 77.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.459 -0.775 . . . . 0.0 111.358 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.461 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -76.15 -35.44 59.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.375 -1.453 . . . . 0.0 110.158 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.3 mt-10 -62.21 -27.74 69.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.036 -1.04 . . . . 0.0 110.019 -177.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 29.9 mt -39.72 -41.01 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 121.7 -0.625 . . . . 0.0 110.346 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.8 m120 -170.32 157.87 6.38 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.07 -1.019 . . . . 0.0 109.341 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 58.4 p30 -94.15 63.25 3.11 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.3 144.28 27.8 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.165 -0.959 . . . . 0.0 108.942 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.25 -60.57 0.06 OUTLIER 'Trans proline' 0 C--N 1.312 -1.356 0 C-N-CA 122.164 1.909 . . . . 0.0 111.771 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' N ' ' HD2' ' A' ' 24' ' ' LYS . 4.7 mptp? -61.33 -36.1 79.23 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.307 -0.87 . . . . 0.0 109.493 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.597 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.3 ttt-85 -57.99 -45.98 85.92 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.978 -1.076 . . . . 0.0 109.192 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -61.46 -56.82 15.93 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.223 -0.923 . . . . 0.0 109.458 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -51.75 -35.25 42.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.498 -0.751 . . . . 0.0 109.585 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -63.17 -62.3 1.79 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 110.655 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.53 HD11 ' NH1' ' A' ' 25' ' ' ARG . 62.8 mt -53.23 -46.82 69.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.882 . . . . 0.0 109.322 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.461 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.1 m-20 -61.27 -46.91 88.4 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.086 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.403 -0.81 . . . . 0.0 110.067 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.621 HD23 HD13 ' A' ' 56' ' ' LEU . 63.5 tp -59.04 -50.06 75.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.028 -1.045 . . . . 0.0 110.733 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -63.06 -35.51 80.5 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.357 -1.337 . . . . 0.0 107.796 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 t -68.25 -52.52 32.99 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.522 -0.736 . . . . 0.0 109.702 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.61 -42.52 88.38 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.506 -0.746 . . . . 0.0 110.378 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.516 ' CE ' ' O ' ' A' ' 41' ' ' THR . 61.6 mmm -60.13 -38.59 83.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.478 -0.764 . . . . 0.0 111.027 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -57.7 -37.06 72.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.658 -1.276 . . . . 0.0 108.833 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -67.36 -47.88 69.12 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.338 -0.851 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 39' ' ' ARG . 2.6 mmm-85 -63.63 -22.59 66.98 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.21 -0.931 . . . . 0.0 110.798 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.24 2.81 61.94 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.516 ' O ' ' CE ' ' A' ' 36' ' ' MET . 60.0 p -116.4 83.64 13.49 Favored Pre-proline 0 N--CA 1.491 1.6 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -85.32 143.81 8.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.877 2.385 . . . . 0.0 111.196 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.7 mt -82.87 103.45 10.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 O-C-N 120.841 -1.162 . . . . 0.0 109.818 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -67.37 -55.82 12.2 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.583 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.1 OUTLIER -127.31 133.64 50.09 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.177 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.466 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.91 146.35 92.97 Favored Pre-proline 0 C--N 1.3 -1.571 0 O-C-N 121.074 -1.016 . . . . 0.0 109.59 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -70.27 132.17 21.97 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.536 1.491 . . . . 0.0 108.967 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mt -99.55 141.4 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 120.771 -1.206 . . . . 0.0 109.917 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.3 mtp -140.78 121.19 14.03 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 72.05 39.76 0.78 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.6 mttm 59.41 20.57 8.9 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.257 0.551 . . . . 0.0 110.161 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -139.74 159.35 42.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.093 -1.005 . . . . 0.0 109.395 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.15 146.35 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.985 -1.072 . . . . 0.0 109.414 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.7 HD21 HD22 ' A' ' 59' ' ' LEU . 57.7 tp -78.29 124.8 28.5 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.197 -0.94 . . . . 0.0 108.936 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.17 98.41 0.14 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.692 -0.63 . . . . 0.0 110.449 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.621 HD13 HD23 ' A' ' 32' ' ' LEU . 55.8 mt -56.16 -28.0 56.41 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.97 -1.081 . . . . 0.0 108.566 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -77.68 -60.77 2.23 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.178 -0.951 . . . . 0.0 111.825 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.7 -37.87 74.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.778 -1.201 . . . . 0.0 109.257 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.7 HD22 HD21 ' A' ' 54' ' ' LEU . 52.1 tp -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CE2' HG13 ' A' ' 64' ' ' ILE . 48.8 t80 -62.13 -66.91 0.47 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.674 -0.641 . . . . 0.0 110.072 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 60' ' ' TYR . 58.1 t30 -40.02 -40.86 1.12 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.537 -0.727 . . . . 0.0 111.21 -178.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 mt -73.97 -46.67 42.48 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.031 -1.467 . . . . 0.0 108.023 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.777 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.3 t -53.97 -44.15 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.001 -1.062 . . . . 0.0 109.833 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.401 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.3 mm -68.22 -36.47 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.685 -1.259 . . . . 0.0 107.794 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.82 -15.64 22.28 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.669 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.688 HH21 ' CB ' ' A' ' 80' ' ' GLU . 18.1 mmt-85 -98.27 1.71 47.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.346 -1.471 . . . . 0.0 108.554 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.31 13.01 74.77 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.42 -0.895 . . . . 0.0 111.572 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.87 137.29 3.73 Favored Glycine 0 N--CA 1.504 3.193 0 O-C-N 120.532 -1.569 . . . . 0.0 111.901 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.531 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.6 tp -51.85 -41.72 62.04 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.756 -0.85 . . . . 0.0 110.29 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 122' ' ' LEU . 93.2 t -57.78 -43.72 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.009 -1.057 . . . . 0.0 109.413 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -57.07 -40.48 76.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.067 -1.021 . . . . 0.0 109.238 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 50.8 t -61.83 -43.41 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.45 -0.781 . . . . 0.0 109.916 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -58.55 6.34 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 O-C-N 120.711 -1.243 . . . . 0.0 110.394 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -57.74 -41.05 81.08 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.147 -0.971 . . . . 0.0 110.667 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -93.46 -9.81 37.2 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 19.2 mtmt 59.07 59.36 2.79 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.289 -0.882 . . . . 0.0 109.643 -178.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.2 mt -93.95 15.58 16.49 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.89 -1.131 . . . . 0.0 108.592 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.531 ' HH2' HD11 ' A' ' 69' ' ' LEU . 86.9 m95 -63.02 -41.68 99.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.358 -0.838 . . . . 0.0 108.924 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.0 mt-30 -48.86 -39.11 24.45 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.519 -1.363 . . . . 0.0 108.442 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.688 ' CB ' HH21 ' A' ' 66' ' ' ARG . 73.7 mm-40 -66.32 -38.65 88.19 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.1 mt -75.26 -52.2 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 0.0 109.09 178.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.0 mt -51.25 -53.77 13.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.323 -0.861 . . . . 0.0 109.03 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -69.75 -38.71 76.9 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.27 -0.894 . . . . 0.0 109.334 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.43 -34.36 48.69 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 88.7 mt -86.68 -8.71 57.19 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.445 -1.033 . . . . 0.0 108.587 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 64.29 40.36 6.67 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.758 -0.589 . . . . 0.0 109.901 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -74.61 143.67 79.3 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 108.996 178.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 50' ' ' ALA . 37.4 Cg_endo -70.2 143.3 48.3 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.982 1.788 . . . . 0.0 111.597 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p -60.23 1.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.892 . . . . 0.0 110.162 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 88' ' ' PRO . 91.4 p -66.43 -22.2 66.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.162 -0.962 . . . . 0.0 110.062 -178.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.547 HD11 ' H ' ' A' ' 50' ' ' ALA . 65.4 mt -100.11 106.18 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.927 -1.108 . . . . 0.0 109.346 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.7 p -78.56 -25.33 45.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -0.949 . . . . 0.0 108.714 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -93.88 32.36 1.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' O ' ' C ' ' A' ' 95' ' ' ALA . . . -63.77 -65.5 0.67 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.32 -0.863 . . . . 0.0 109.096 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.33 -52.14 17.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.99 -1.069 . . . . 0.0 108.99 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.454 ' O ' ' OG1' ' A' ' 100' ' ' THR . 8.4 tp -58.03 -44.76 87.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.097 -1.002 . . . . 0.0 109.191 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.3 m -61.78 -39.67 92.5 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.089 -1.007 . . . . 0.0 108.758 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 95' ' ' ALA . 11.2 mt -67.44 -45.16 76.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.511 -0.743 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -68.93 -49.24 59.81 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.139 -0.976 . . . . 0.0 111.219 -179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -55.01 -54.42 43.2 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 120.913 -1.117 . . . . 0.0 109.565 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -63.42 -42.38 98.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.097 -1.002 . . . . 0.0 111.777 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.777 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.13 -42.73 81.47 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.162 -1.586 . . . . 0.0 109.142 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.758 ' SD ' HD11 ' A' ' 126' ' ' ILE . 84.7 mtp -54.41 -56.21 20.94 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.623 -0.673 . . . . 0.0 112.337 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -71.4 -48.89 46.97 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.28 -1.512 . . . . 0.0 112.392 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.516 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -86.29 -52.35 5.69 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -174.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.751 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.0 mp -98.0 12.15 35.2 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.287 -1.508 . . . . 0.0 113.74 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.569 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 55.2 t80 -66.89 -37.15 13.15 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 119.93 -1.731 . . . . 0.0 111.638 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.7 Cg_endo -82.47 -38.75 0.17 Allowed 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.705 1.604 . . . . 0.0 112.532 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.7 -41.39 86.19 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -72.02 -49.34 37.69 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.569 -0.707 . . . . 0.0 109.926 179.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.8 OUTLIER -73.82 -45.48 51.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.324 -0.86 . . . . 0.0 110.891 -178.615 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.43 -47.77 72.15 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.057 -1.027 . . . . 0.0 110.905 -178.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 22.0 mmtp -77.02 -27.33 54.54 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 120.978 -1.076 . . . . 0.0 111.333 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.483 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.8 tptp -125.3 -29.27 3.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.9 -1.125 . . . . 0.0 111.536 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 111' ' ' CYS . 61.6 t30 59.45 45.13 14.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.59 -1.319 . . . . 0.0 109.987 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.483 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.5 mt -67.82 -33.63 75.16 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.301 -0.875 . . . . 0.0 111.211 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 118' ' ' THR . 28.8 t -154.28 -166.98 2.49 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.627 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.547 ' N ' ' OG ' ' A' ' 117' ' ' SER . 77.9 p -128.45 163.36 45.08 Favored Pre-proline 0 N--CA 1.498 1.934 0 O-C-N 121.795 -0.566 . . . . 0.0 109.86 -178.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.413 ' CD ' ' OH ' ' A' ' 107' ' ' TYR . 35.9 Cg_exo -59.7 -40.31 65.71 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 121.763 1.642 . . . . 0.0 112.404 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.08 -37.94 89.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.825 -1.172 . . . . 0.0 109.665 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.406 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -67.0 -44.92 79.13 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.692 HD21 ' HG2' ' A' ' 103' ' ' MET . 19.1 tp -66.51 -53.19 37.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.597 -0.69 . . . . 0.0 110.275 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -56.18 -46.55 79.34 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 108.982 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.79 -39.31 88.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.468 -0.77 . . . . 0.0 109.77 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.51 76.48 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.233 -0.917 . . . . 0.0 108.664 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.758 HD11 ' SD ' ' A' ' 103' ' ' MET . 16.9 mt -65.01 -49.48 79.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.89 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -62.08 -37.94 86.93 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.44 -32.72 85.15 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.622 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.1 OUTLIER -93.94 -33.51 13.44 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.805 -1.409 . . . . 0.0 110.592 -179.017 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.617 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 54.6 mtp180 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 120.748 -1.22 . . . . 0.0 109.616 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.708 ' O ' HG13 ' A' ' 13' ' ' VAL . 11.1 mm100 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.176 0.512 . . . . 0.0 109.879 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CE1' ' NE ' ' A' ' 14' ' ' ARG . 84.6 t80 -58.75 -52.54 65.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.213 -0.93 . . . . 0.0 109.733 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -61.5 -47.11 87.11 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.272 -0.893 . . . . 0.0 109.889 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.438 ' O ' HD11 ' A' ' 46' ' ' LEU . 90.4 mt-30 -63.85 -50.42 68.93 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.418 -0.801 . . . . 0.0 110.896 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.708 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.4 m -69.48 -34.61 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 120.61 -1.306 . . . . 0.0 108.595 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.64 ' NE ' ' CE1' ' A' ' 10' ' ' PHE . 13.1 mmt180 -62.68 -39.95 95.56 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.512 -1.367 . . . . 0.0 107.787 178.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -56.71 -26.02 55.83 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.496 ' CD1' HD13 ' A' ' 46' ' ' LEU . 7.7 mt -78.66 -37.59 41.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.536 -0.727 . . . . 0.0 111.835 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.42 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -79.35 -31.08 42.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.389 -1.445 . . . . 0.0 110.468 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -63.61 -29.81 71.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.882 -1.136 . . . . 0.0 109.639 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.513 HD13 HH22 ' A' ' 25' ' ' ARG . 56.9 mt -43.07 -45.47 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 O-C-N 121.571 -0.705 . . . . 0.0 110.248 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.456 ' OD1' ' O ' ' A' ' 20' ' ' ASN . 26.4 p30 179.98 125.46 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.238 -0.914 . . . . 0.0 108.618 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -82.21 78.1 8.93 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 111.416 -177.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -98.01 124.23 48.36 Favored Pre-proline 0 N--CA 1.489 1.487 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -36.39 -57.52 0.58 Allowed 'Trans proline' 0 C--N 1.313 -1.295 0 C-N-CA 122.208 1.938 . . . . 0.0 113.22 -178.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -62.78 -42.07 99.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.047 -1.033 . . . . 0.0 110.76 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.513 HH22 HD13 ' A' ' 19' ' ' ILE . 60.7 ttt180 -60.67 -45.13 95.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.809 -1.182 . . . . 0.0 111.678 -178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -59.89 -51.18 70.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.37 -1.456 . . . . 0.0 108.701 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -54.68 -36.46 64.67 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -59.11 -66.04 0.57 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.277 -0.889 . . . . 0.0 110.221 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.8 mt -55.95 -43.0 77.04 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.495 0.664 . . . . 0.0 109.535 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -60.36 -50.25 74.34 Favored 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.305 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -66.98 -43.56 82.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.227 -0.921 . . . . 0.0 109.838 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.456 ' O ' ' CG ' ' A' ' 36' ' ' MET . 46.9 tp -54.69 -54.07 46.62 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.336 -0.853 . . . . 0.0 110.198 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.34 -33.64 75.97 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.594 -1.316 . . . . 0.0 108.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.6 t -69.81 -63.19 1.12 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.618 -0.676 . . . . 0.0 111.271 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.467 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -62.01 -32.09 72.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.111 -0.993 . . . . 0.0 110.723 -178.511 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.456 ' CG ' ' O ' ' A' ' 32' ' ' LEU . 62.2 mmm -59.43 -34.92 73.1 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.985 -1.072 . . . . 0.0 109.866 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -61.59 -40.15 93.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.242 -0.911 . . . . 0.0 110.321 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -58.43 -48.08 81.87 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.474 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.3 OUTLIER -63.71 -21.93 66.65 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.385 -0.822 . . . . 0.0 110.559 -178.35 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.62 7.43 60.26 Favored Glycine 0 N--CA 1.481 1.643 0 N-CA-C 107.837 -2.105 . . . . 0.0 107.837 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 p -117.89 85.2 22.33 Favored Pre-proline 0 N--CA 1.492 1.641 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -93.73 146.72 2.13 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 123.346 2.697 . . . . 0.0 112.154 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.2 mt -79.22 95.59 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 109.535 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.453 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 89.7 m-20 -59.37 -28.58 67.0 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -160.64 138.22 9.44 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.496 HD13 ' CD1' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -71.69 145.2 89.43 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 120.976 -1.078 . . . . 0.0 108.544 -179.365 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -66.77 131.34 25.51 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.235 1.29 . . . . 0.0 109.215 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.9 mt -97.39 143.31 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 120.903 -1.123 . . . . 0.0 110.126 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.687 ' SD ' HD13 ' A' ' 54' ' ' LEU . 75.1 mtp -138.98 121.92 16.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 67.78 40.56 2.4 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.1 mttm 57.17 24.24 9.54 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.47 0.652 . . . . 0.0 109.459 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.2 m -135.43 153.42 51.79 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.38 -0.825 . . . . 0.0 109.144 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -70.44 146.64 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.055 -1.028 . . . . 0.0 109.328 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.687 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.4 tp -79.14 123.8 27.72 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.402 -0.811 . . . . 0.0 110.445 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -65.49 88.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 56' ' ' LEU . 19.3 mt -54.42 -24.1 18.56 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 120.995 -1.066 . . . . 0.0 109.552 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.627 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 41.7 t80 -82.29 -56.6 3.81 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 111.735 -178.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.54 -38.49 81.16 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.531 -1.356 . . . . 0.0 109.321 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.467 HD22 HD21 ' A' ' 54' ' ' LEU . 53.6 tp -57.46 -46.49 83.59 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.436 ' CE2' HG13 ' A' ' 64' ' ' ILE . 46.3 t80 -56.98 -64.58 0.83 Allowed 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.627 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 10.7 m-20 -44.3 -40.16 5.06 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.389 -0.819 . . . . 0.0 111.128 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 66' ' ' ARG . 6.9 mt -72.07 -44.34 63.46 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 118.085 -1.446 . . . . 0.0 107.518 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.744 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -60.09 -44.49 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 60' ' ' TYR . 12.3 mm -67.91 -36.5 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.467 -1.396 . . . . 0.0 107.981 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.452 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.4 -20.84 21.39 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.174 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.608 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -93.41 1.5 56.85 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.596 -1.315 . . . . 0.0 109.304 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.89 15.29 75.56 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.014 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.73 2.97 Favored Glycine 0 N--CA 1.498 2.816 0 O-C-N 120.463 -1.61 . . . . 0.0 111.309 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.6 tp -48.45 -38.13 19.05 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.71 -0.876 . . . . 0.0 110.785 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.454 HG22 ' HA ' ' A' ' 122' ' ' LEU . 97.0 t -57.95 -41.74 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 120.846 -1.159 . . . . 0.0 110.476 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -58.78 -37.6 76.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.97 . . . . 0.0 109.914 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' LYS . 21.2 t -66.13 -42.5 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 110.643 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.408 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 48.3 mt -69.48 -57.92 7.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 120.828 -1.17 . . . . 0.0 110.548 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.406 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 92.8 m-20 -58.01 -41.53 83.33 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.047 -1.033 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -92.4 -7.98 46.15 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.261 -0.899 . . . . 0.0 110.428 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.7 mttp 58.12 55.69 5.03 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.309 -0.87 . . . . 0.0 110.592 -179.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 11.1 mt -90.61 12.45 18.86 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.699 -1.25 . . . . 0.0 107.835 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.562 ' CH2' HD11 ' A' ' 69' ' ' LEU . 98.3 m95 -62.31 -41.34 98.46 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mm100 -48.86 -37.71 20.33 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.737 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.608 ' CB ' HH21 ' A' ' 66' ' ' ARG . 93.3 mt-10 -69.62 -40.82 76.35 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -67.49 -53.51 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.489 HD11 ' HB2' ' A' ' 95' ' ' ALA . 62.6 mt -51.27 -57.65 2.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.299 -0.876 . . . . 0.0 109.266 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -66.83 -37.4 84.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.153 -0.967 . . . . 0.0 109.467 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.42 ' O ' ' CE1' ' A' ' 86' ' ' HIS . . . -53.91 -37.59 58.21 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.71 -8.71 58.75 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.329 -1.101 . . . . 0.0 108.17 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.42 ' CE1' ' O ' ' A' ' 84' ' ' GLY . 18.7 m80 69.0 41.16 1.48 Allowed 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.236 0.541 . . . . 0.0 110.844 179.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -73.4 148.44 88.23 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.196 -0.94 . . . . 0.0 108.789 177.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.29 170.25 18.75 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.301 2.001 . . . . 0.0 112.282 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.5 t -79.55 -1.74 39.16 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.46 -0.775 . . . . 0.0 109.4 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 24.4 m -65.06 -33.97 77.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.504 -0.748 . . . . 0.0 110.652 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.532 HD11 ' H ' ' A' ' 50' ' ' ALA . 86.0 mt -92.76 98.89 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 120.637 -1.289 . . . . 0.0 109.263 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 31.9 p -72.21 -30.49 64.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.077 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.4 m -97.5 45.19 1.03 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.496 -0.752 . . . . 0.0 109.43 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -59.55 3.34 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.113 -0.992 . . . . 0.0 108.868 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.489 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.18 -50.55 15.57 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.197 -0.939 . . . . 0.0 109.633 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.466 ' O ' ' OG1' ' A' ' 100' ' ' THR . 7.4 tp -58.19 -43.75 87.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.681 -1.262 . . . . 0.0 109.023 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.1 m -62.5 -40.76 97.77 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.055 -1.028 . . . . 0.0 108.822 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 95' ' ' ALA . 9.3 mt -69.3 -42.87 74.87 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.562 -0.711 . . . . 0.0 110.252 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.764 ' NH1' HD21 ' A' ' 129' ' ' ASN . 46.4 ttp180 -69.24 -50.11 50.11 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.155 -0.966 . . . . 0.0 110.859 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -54.31 -54.58 38.36 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.026 -1.046 . . . . 0.0 109.419 -179.015 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -62.86 -41.19 99.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.16 -0.962 . . . . 0.0 111.468 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.744 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.5 t80 -58.16 -43.93 87.65 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 119.826 -1.796 . . . . 0.0 109.153 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.658 ' HG2' HD21 ' A' ' 122' ' ' LEU . 86.3 mtp -51.96 -56.52 13.69 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.78 -0.575 . . . . 0.0 112.097 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.1 mttm -73.48 -51.08 18.38 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.517 -1.364 . . . . 0.0 112.553 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.53 ' C ' HD12 ' A' ' 106' ' ' LEU . 69.7 m-85 -85.49 -48.1 9.28 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -174.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.8 mp -97.5 -1.51 43.93 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.23 -1.544 . . . . 0.0 113.433 -176.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.656 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 66.2 t80 -64.15 -36.06 18.06 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 119.865 -1.772 . . . . 0.0 109.709 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 10.6 Cg_exo -66.81 -51.73 0.83 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 C-N-CA 121.801 1.667 . . . . 0.0 111.213 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -58.03 -50.29 73.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.233 -0.917 . . . . 0.0 109.271 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.45 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 85.9 tt0 -65.67 -43.94 87.76 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.296 -0.878 . . . . 0.0 110.843 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.3 -45.31 18.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.983 . . . . 0.0 110.422 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 108' ' ' PRO . 32.0 tt0 -67.65 -51.87 44.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.269 -0.894 . . . . 0.0 111.417 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -75.33 -29.62 60.03 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -0.97 . . . . 0.0 111.961 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.504 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.5 tptp -123.33 -28.92 3.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.972 -1.08 . . . . 0.0 111.852 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 30.0 t30 57.86 46.02 17.51 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.742 -1.224 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.504 HD21 ' HG2' ' A' ' 114' ' ' LYS . 93.7 mt -65.86 -31.79 72.94 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.917 -1.114 . . . . 0.0 110.94 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.595 ' OG ' ' N ' ' A' ' 118' ' ' THR . 10.7 t -153.91 -167.01 2.53 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 119.001 -1.08 . . . . 0.0 111.192 -178.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.595 ' N ' ' OG ' ' A' ' 117' ' ' SER . 53.9 p -129.35 155.55 79.86 Favored Pre-proline 0 N--CA 1.5 2.054 0 O-C-N 121.474 -0.766 . . . . 0.0 110.583 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -49.91 -43.19 42.37 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 122.106 1.871 . . . . 0.0 112.42 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.14 88.58 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.789 -1.194 . . . . 0.0 109.371 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.442 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -65.97 -45.61 81.08 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 103' ' ' MET . 44.2 tp -66.54 -53.42 35.04 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 110.415 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -56.03 -45.04 79.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.775 -1.203 . . . . 0.0 109.128 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.27 96.67 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.461 -0.775 . . . . 0.0 110.333 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.406 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.31 -35.79 78.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 108.686 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.528 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 24.3 mt -64.77 -48.04 86.14 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 CA-C-O 121.536 0.684 . . . . 0.0 109.189 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -65.71 -36.93 85.02 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.045 -1.034 . . . . 0.0 108.967 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -63.4 -32.88 85.65 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.764 HD21 ' NH1' ' A' ' 99' ' ' ARG . 10.9 p-10 -94.02 -31.52 14.2 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.886 -1.361 . . . . 0.0 110.305 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.623 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 48.3 mtp180 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 120.926 -1.109 . . . . 0.0 109.948 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.937 ' O ' HG12 ' A' ' 13' ' ' VAL . 37.8 mt-30 . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.908 0.385 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -55.54 -45.96 77.17 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.927 -1.108 . . . . 0.0 109.0 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -61.32 -41.34 96.84 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.821 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -66.32 -53.22 38.93 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.42 -0.8 . . . . 0.0 111.378 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.937 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.0 p -70.04 -35.49 64.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.084 -1.01 . . . . 0.0 110.688 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HG2' HH11 ' A' ' 14' ' ' ARG . 1.1 tpt180 -62.18 -36.08 80.78 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 119.761 -1.837 . . . . 0.0 107.864 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -59.32 -32.58 70.2 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HA ' HD12 ' A' ' 19' ' ' ILE . 8.2 mt -63.03 -39.12 93.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.345 -0.847 . . . . 0.0 110.648 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -80.46 -36.31 33.71 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.565 -1.335 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' A' ' 14' ' ' ARG . 76.5 mm-40 -65.23 -30.05 70.9 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.903 -1.123 . . . . 0.0 111.024 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.687 HG21 HH12 ' A' ' 25' ' ' ARG . 15.5 mt -38.13 -39.01 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 O-C-N 121.506 -0.746 . . . . 0.0 111.061 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -170.3 163.11 8.75 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.563 -1.336 . . . . 0.0 110.785 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -90.04 67.06 6.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.775 -0.578 . . . . 0.0 110.494 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.408 ' OD1' ' C ' ' A' ' 22' ' ' ASP . 51.7 t0 -111.98 99.46 45.78 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -49.62 -47.62 22.2 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.392 2.061 . . . . 0.0 112.845 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -37.65 80.14 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.035 -1.041 . . . . 0.0 108.951 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.687 HH12 HG21 ' A' ' 19' ' ' ILE . 66.0 ttt180 -60.34 -36.82 78.85 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.263 -0.898 . . . . 0.0 109.46 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.57 -50.46 73.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.189 -0.945 . . . . 0.0 109.177 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -53.41 -36.92 62.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 109.288 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.72 -61.72 2.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.51 -0.744 . . . . 0.0 110.926 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 65.1 mt -53.75 -48.21 69.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.449 -0.782 . . . . 0.0 110.204 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 78.6 m-20 -59.83 -51.73 68.49 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.39 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -65.92 -42.15 90.48 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.966 -1.084 . . . . 0.0 109.794 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.64 -51.26 70.23 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.006 -1.059 . . . . 0.0 110.28 -178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CE2' HG23 ' A' ' 13' ' ' VAL . 46.3 m-85 -60.21 -34.59 73.86 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 118.441 -1.303 . . . . 0.0 108.01 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.6 m -67.48 -54.03 23.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.819 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -60.3 -39.48 87.1 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.178 -0.952 . . . . 0.0 109.958 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 76.4 mmm -58.72 -42.53 88.94 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.441 -0.787 . . . . 0.0 110.717 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.0 -35.53 81.49 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.892 -1.13 . . . . 0.0 109.726 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -59.0 -53.45 58.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.213 -0.929 . . . . 0.0 109.722 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.477 HH11 ' HB3' ' A' ' 108' ' ' PRO . 25.7 mtp180 -64.53 -18.04 64.47 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.503 -0.748 . . . . 0.0 111.626 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.57 5.09 60.37 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 107.817 -2.113 . . . . 0.0 107.817 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.9 p -115.62 83.74 11.58 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -87.12 146.44 7.63 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.898 2.398 . . . . 0.0 111.286 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.96 99.11 4.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 120.869 -1.144 . . . . 0.0 109.185 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.503 ' CB ' HH21 ' A' ' 45' ' ' ARG . 92.7 m-20 -64.99 -49.84 68.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.148 -0.97 . . . . 0.0 109.108 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.503 HH21 ' CB ' ' A' ' 44' ' ' ASN . 7.7 mtm180 -135.56 137.26 41.84 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.305 -0.872 . . . . 0.0 108.832 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 16' ' ' LEU . 17.9 mt -71.9 141.96 84.98 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 120.951 -1.093 . . . . 0.0 109.368 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -71.16 108.16 2.28 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 121.483 1.455 . . . . 0.0 109.785 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.52 HG23 ' N ' ' A' ' 52' ' ' SER . 49.9 mt -76.92 143.22 13.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 110.298 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.604 ' SD ' HG21 ' A' ' 97' ' ' THR . 28.8 mmm -137.55 124.63 21.54 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.09 41.08 8.47 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.027 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.6 mttp 60.5 23.03 12.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.982 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.52 ' N ' HG23 ' A' ' 48' ' ' ILE . 50.9 m -136.42 153.01 51.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.102 -0.999 . . . . 0.0 109.59 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.457 HG13 ' H ' ' A' ' 53' ' ' VAL . 1.1 m -65.94 143.57 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 108.895 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 59' ' ' LEU . 33.7 tp -75.12 122.45 23.61 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.076 -1.015 . . . . 0.0 109.554 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.04 97.16 0.08 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.423 -0.798 . . . . 0.0 109.022 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.7 mt -58.59 -27.98 65.14 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.3 -0.875 . . . . 0.0 109.138 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -80.27 -62.18 1.76 Allowed 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.863 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -55.51 -37.14 67.48 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.692 -1.255 . . . . 0.0 110.075 -178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 54' ' ' LEU . 19.4 tp -63.11 -45.2 93.15 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.433 ' CE2' HG13 ' A' ' 64' ' ' ILE . 63.4 t80 -62.16 -66.57 0.52 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 60' ' ' TYR . 50.7 t-20 -42.54 -37.7 1.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.612 -0.68 . . . . 0.0 109.355 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.878 HD22 HH22 ' A' ' 66' ' ' ARG . 11.5 mt -70.36 -48.58 55.67 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 102' ' ' TYR . 30.4 t -55.58 -42.17 67.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.256 -0.903 . . . . 0.0 110.051 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.433 HG13 ' CE2' ' A' ' 60' ' ' TYR . 10.9 mm -71.16 -33.59 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 120.795 -1.19 . . . . 0.0 107.888 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.53 -19.38 24.62 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.738 -0.785 . . . . 0.0 109.56 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.878 HH22 HD22 ' A' ' 62' ' ' LEU . 13.4 mmt-85 -96.79 -3.24 42.64 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.736 -1.228 . . . . 0.0 108.273 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 13.16 71.78 Favored Glycine 0 N--CA 1.491 2.341 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.059 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.07 131.45 2.45 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.297 -1.707 . . . . 0.0 111.714 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.733 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.6 tp -50.2 -41.21 49.19 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.589 -0.947 . . . . 0.0 109.998 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.425 HG22 ' HA ' ' A' ' 122' ' ' LEU . 80.0 t -61.49 -43.15 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.148 -0.97 . . . . 0.0 109.732 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -55.24 -38.8 68.97 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.971 -1.08 . . . . 0.0 108.862 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.637 ' O ' ' N ' ' A' ' 76' ' ' LYS . 47.0 t -64.22 -42.55 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.653 -0.654 . . . . 0.0 109.587 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.483 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 95.1 mt -65.38 -59.06 4.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.68 0 O-C-N 121.052 -1.03 . . . . 0.0 110.679 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -58.26 -40.58 82.21 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.104 -0.998 . . . . 0.0 110.4 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.7 mmtt -93.14 -12.22 30.94 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.211 -0.931 . . . . 0.0 110.855 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.637 ' N ' ' O ' ' A' ' 72' ' ' VAL . 15.1 mtmt 59.67 62.68 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.252 -0.905 . . . . 0.0 110.102 -178.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.1 14.33 24.21 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.094 -1.004 . . . . 0.0 108.627 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.523 ' NE1' HG12 ' A' ' 72' ' ' VAL . 81.8 m95 -63.44 -39.22 93.91 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.291 -0.881 . . . . 0.0 109.341 179.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.4 mm-40 -49.31 -38.29 27.12 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.651 -1.281 . . . . 0.0 108.28 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.599 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.9 mm-40 -70.53 -42.2 71.54 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.427 HG12 ' NH2' ' A' ' 66' ' ' ARG . 3.7 mt -67.34 -54.73 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' A' ' 95' ' ' ALA . 58.5 mt -53.37 -53.6 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.575 -0.703 . . . . 0.0 109.973 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -65.81 -41.31 92.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.014 -1.054 . . . . 0.0 109.627 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.48 -32.72 46.08 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.2 mt -88.93 -8.48 54.1 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.379 -1.071 . . . . 0.0 108.991 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 15.8 m80 65.32 40.8 4.64 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 109.935 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.2 mt -73.42 119.21 74.67 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.341 -0.85 . . . . 0.0 109.385 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.465 ' C ' ' H ' ' A' ' 90' ' ' SER . 52.0 Cg_exo -48.44 141.96 18.36 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 121.719 1.613 . . . . 0.0 112.229 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.8 p -59.58 -1.61 0.26 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.286 -0.884 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 88' ' ' PRO . 83.8 p -66.45 -22.9 66.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.168 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.521 HD13 ' SD ' ' A' ' 49' ' ' MET . 71.2 mt -97.78 107.48 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 120.803 -1.185 . . . . 0.0 109.46 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.5 p -78.48 -28.12 46.39 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.8 m -88.67 29.58 0.99 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.675 -0.64 . . . . 0.0 109.358 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.67 -66.64 0.46 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.508 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.8 -53.5 31.45 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.457 -0.777 . . . . 0.0 109.501 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.8 tp -57.36 -45.43 84.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 109.049 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.604 HG21 ' SD ' ' A' ' 49' ' ' MET . 49.6 m -60.2 -40.34 89.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.155 -0.966 . . . . 0.0 108.744 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.425 HD22 HD13 ' A' ' 59' ' ' LEU . 10.9 mt -70.8 -47.16 60.94 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.493 -0.754 . . . . 0.0 110.009 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.657 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.8 ttm180 -62.89 -51.87 65.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.003 -1.061 . . . . 0.0 111.3 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.1 m -56.7 -54.84 41.53 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.05 -1.031 . . . . 0.0 110.531 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.56 -41.87 99.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.359 -0.838 . . . . 0.0 111.264 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.867 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.5 t80 -57.88 -40.53 80.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.576 -1.328 . . . . 0.0 109.521 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.548 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -52.82 -55.32 23.88 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.415 -0.803 . . . . 0.0 110.999 -178.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -73.36 -53.37 10.93 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.874 -1.141 . . . . 0.0 112.882 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -84.6 -46.99 10.99 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -174.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.631 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.3 mp -97.45 -8.7 28.74 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.148 -1.595 . . . . 0.0 114.23 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.655 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 14.3 t80 -60.49 -38.37 56.65 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 119.725 -1.859 . . . . 0.0 109.099 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 52.5 Cg_exo -58.7 -59.74 0.44 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.578 2.186 . . . . 0.0 112.81 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -59.17 -40.86 86.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.614 -0.679 . . . . 0.0 109.518 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -69.99 -46.03 66.05 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.457 -0.777 . . . . 0.0 110.4 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ASN . 17.0 t -76.99 -45.62 26.72 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.234 -0.916 . . . . 0.0 109.912 -179.044 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -66.3 -49.81 65.78 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.245 -0.909 . . . . 0.0 111.266 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 28.9 mmtm -74.2 -29.34 61.7 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.971 -1.081 . . . . 0.0 111.545 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.576 ' HG2' HD21 ' A' ' 116' ' ' LEU . 19.6 tptp -125.04 -28.11 3.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.897 -1.127 . . . . 0.0 111.703 -177.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 111' ' ' CYS . 55.1 t30 56.28 47.5 19.08 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.666 -1.271 . . . . 0.0 110.619 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 114' ' ' LYS . 61.8 mt -69.02 -30.06 68.37 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.178 -0.951 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 8.1 t -154.16 -165.94 2.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.017 -1.052 . . . . 0.0 111.092 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 70.6 p -130.48 155.49 81.01 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.562 -0.711 . . . . 0.0 109.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.54 -40.09 64.08 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.862 1.708 . . . . 0.0 112.526 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.99 89.24 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.836 -1.165 . . . . 0.0 109.384 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -66.36 -42.71 87.66 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.548 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.3 tp -68.75 -51.45 41.11 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.557 -0.714 . . . . 0.0 110.212 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -58.94 -45.08 91.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.936 -1.103 . . . . 0.0 109.365 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.66 -42.46 98.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.131 -0.981 . . . . 0.0 110.327 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.91 -32.21 72.53 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 122.094 0.95 . . . . 0.0 108.728 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.488 ' HA ' ' ND2' ' A' ' 129' ' ' ASN . 4.9 mt -64.53 -51.4 68.27 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -63.72 -38.77 92.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 109.381 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -59.9 -34.02 81.13 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.657 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 7.7 p30 -93.46 -35.49 12.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.138 -1.213 . . . . 0.0 110.117 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.526 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 55.9 mtp180 . . . . . 0 N--CA 1.492 1.665 0 O-C-N 120.933 -1.104 . . . . 0.0 109.735 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.621 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.3 mt-30 . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -49.73 -50.52 43.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -62.58 -37.2 85.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.108 -0.995 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.43 -52.64 51.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.979 -1.075 . . . . 0.0 111.969 -178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -68.87 -33.85 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 120.824 -1.173 . . . . 0.0 110.567 -179.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -67.32 -36.4 81.4 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.053 -1.655 . . . . 0.0 108.702 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -59.16 -28.98 67.1 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 46' ' ' LEU . 10.4 mt -67.66 -42.32 82.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.398 -0.814 . . . . 0.0 111.634 -179.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.8 m-85 -76.32 -33.75 59.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.37 -1.456 . . . . 0.0 109.634 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.496 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.7 mm-40 -62.62 -31.56 72.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.025 -1.047 . . . . 0.0 110.243 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.601 HD13 ' NH2' ' A' ' 25' ' ' ARG . 32.2 mt -36.98 -40.69 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.737 -0.602 . . . . 0.0 110.312 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.24 161.37 5.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.857 -1.152 . . . . 0.0 110.256 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -92.13 73.78 5.47 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -110.93 137.51 20.88 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -71.78 -62.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.251 1.967 . . . . 0.0 112.643 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -58.0 -33.64 69.15 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.056 -1.027 . . . . 0.0 109.276 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.601 ' NH2' HD13 ' A' ' 19' ' ' ILE . 58.0 ttt180 -61.87 -41.08 97.44 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.862 -1.149 . . . . 0.0 109.994 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -59.8 -59.57 5.22 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.016 -1.052 . . . . 0.0 109.883 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 7.8 pt-20 -53.15 -29.85 33.72 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.551 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -64.55 -61.98 1.87 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.06 . . . . 0.0 109.996 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 16' ' ' LEU . 55.1 mt -53.63 -45.88 70.28 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.349 -0.844 . . . . 0.0 109.557 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -65.56 -49.52 68.57 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.519 -179.696 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.599 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 57.2 t0 -64.87 -39.85 94.19 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.189 -0.945 . . . . 0.0 109.001 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.7 tp -60.76 -49.7 76.44 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.155 -1.018 . . . . 0.0 109.058 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.618 ' CE1' HD12 ' A' ' 43' ' ' ILE . 47.7 m-85 -61.55 -35.3 77.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.6 t -68.08 -54.49 17.82 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.523 -0.735 . . . . 0.0 109.576 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.91 -40.85 85.76 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.227 -0.92 . . . . 0.0 109.722 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.418 ' CE ' ' O ' ' A' ' 41' ' ' THR . 75.2 mmm -60.36 -38.15 82.94 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.577 -0.702 . . . . 0.0 110.013 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -61.85 -39.19 90.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.125 -0.985 . . . . 0.0 109.375 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -64.43 -50.53 67.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.923 . . . . 0.0 111.292 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.463 ' HE ' ' HB2' ' A' ' 108' ' ' PRO . 0.9 OUTLIER -63.69 -18.84 64.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.931 -1.106 . . . . 0.0 111.421 -177.45 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 4.18 61.36 Favored Glycine 0 N--CA 1.482 1.736 0 N-CA-C 107.746 -2.142 . . . . 0.0 107.746 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.418 ' O ' ' CE ' ' A' ' 36' ' ' MET . 19.4 p -114.62 83.38 8.85 Favored Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.37 151.38 13.56 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.729 2.286 . . . . 0.0 111.235 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.618 HD12 ' CE1' ' A' ' 33' ' ' PHE . 18.3 mt -89.11 103.46 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 110.724 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 64.7 m-20 -63.54 -74.51 0.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -116.56 135.26 53.96 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.552 HD22 HD11 ' A' ' 16' ' ' LEU . 5.6 mt -69.15 144.43 95.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.224 -179.194 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -65.82 134.88 39.2 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 121.2 1.267 . . . . 0.0 108.974 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' SER . 6.1 mt -102.37 145.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.024 -1.048 . . . . 0.0 110.242 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 75.6 mtp -142.73 119.3 11.04 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 71.8 39.13 0.88 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.4 mttm 59.77 24.27 13.21 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.242 0.544 . . . . 0.0 109.79 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.8 159.42 42.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.376 -0.827 . . . . 0.0 109.267 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 148.19 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.001 -1.062 . . . . 0.0 109.738 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.597 HD13 ' SD ' ' A' ' 49' ' ' MET . 63.6 tp -76.17 121.23 22.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.508 -0.745 . . . . 0.0 109.668 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.417 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.8 m-20 -65.04 93.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.378 -0.826 . . . . 0.0 109.162 -179.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.9 mt -56.15 -25.22 45.52 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.287 -0.883 . . . . 0.0 109.341 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -81.32 -58.74 2.91 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.2 -0.938 . . . . 0.0 111.759 -179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.37 -36.81 71.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.417 -1.427 . . . . 0.0 109.257 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.551 HD22 HD21 ' A' ' 54' ' ' LEU . 53.0 tp -61.63 -47.48 85.22 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.452 ' O ' ' C ' ' A' ' 61' ' ' ASN . 56.2 t80 -58.81 -70.09 0.16 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 60' ' ' TYR . 63.2 t30 -40.48 -39.31 0.99 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.443 -0.786 . . . . 0.0 109.708 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.521 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 6.1 mt -67.6 -50.73 56.83 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.815 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -57.01 -42.41 79.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.696 -0.628 . . . . 0.0 110.256 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.494 HG23 HD11 ' A' ' 116' ' ' LEU . 5.2 mm -70.15 -29.03 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 62' ' ' LEU . . . -56.21 -29.49 61.03 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.547 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.687 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.1 mmt180 -91.61 -4.41 55.31 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.612 -1.305 . . . . 0.0 108.78 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.66 19.63 59.61 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.332 177.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.42 130.31 2.47 Favored Glycine 0 N--CA 1.498 2.811 0 O-C-N 120.28 -1.718 . . . . 0.0 111.475 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.569 HD11 ' HH2' ' A' ' 78' ' ' TRP . 10.7 tp -50.44 -39.76 48.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.584 -0.951 . . . . 0.0 110.464 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 122' ' ' LEU . 60.1 t -57.02 -43.36 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.006 -1.059 . . . . 0.0 109.691 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -57.68 -39.38 77.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.863 -1.148 . . . . 0.0 109.448 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.6 t -62.38 -42.24 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.365 -0.834 . . . . 0.0 109.516 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.8 mt -66.41 -55.66 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 120.851 -1.156 . . . . 0.0 110.692 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -57.17 -42.0 80.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.02 -1.05 . . . . 0.0 110.351 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -94.58 -8.74 37.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.254 -0.904 . . . . 0.0 110.596 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.618 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.9 mttp 57.3 59.11 3.5 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.291 -0.881 . . . . 0.0 109.513 -177.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -88.29 12.89 12.8 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.011 -1.076 . . . . 0.0 108.77 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.569 ' HH2' HD11 ' A' ' 69' ' ' LEU . 71.3 m95 -63.24 -41.04 99.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.16 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' TRP . 15.5 mm100 -49.37 -38.7 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.292 -1.505 . . . . 0.0 108.53 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.687 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.7 mm-40 -71.32 -45.87 61.98 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 108.896 178.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.448 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.8 mt -64.69 -51.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.625 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.9 mt -52.35 -54.75 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -66.64 -40.93 88.92 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.138 -0.976 . . . . 0.0 109.555 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.44 -32.29 37.66 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.4 mt -89.84 -7.88 53.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.402 -1.058 . . . . 0.0 108.801 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 64.66 42.06 4.94 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.604 -0.685 . . . . 0.0 110.618 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.5 mt -74.42 142.54 78.23 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.081 -1.012 . . . . 0.0 109.224 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 51.7 Cg_endo -72.13 142.16 37.52 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.158 1.906 . . . . 0.0 112.163 179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.1 t -56.49 0.99 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 109.761 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 19.4 m -65.8 -31.35 72.28 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.107 -0.995 . . . . 0.0 109.838 -178.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.625 HD11 ' H ' ' A' ' 50' ' ' ALA . 83.2 mt -93.93 98.26 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 120.822 -1.174 . . . . 0.0 109.486 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.9 p -69.84 -27.94 65.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 108.735 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.9 m -91.23 32.67 1.02 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.519 -0.738 . . . . 0.0 109.164 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.37 -65.52 0.68 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.09 -1.006 . . . . 0.0 108.727 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.625 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.77 -52.05 34.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 109.216 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.53 -43.51 89.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.861 -1.149 . . . . 0.0 109.055 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.6 m -60.56 -39.9 89.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.058 -1.026 . . . . 0.0 108.642 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.458 HD22 HD13 ' A' ' 59' ' ' LEU . 10.4 mt -70.2 -46.72 63.99 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.594 -0.691 . . . . 0.0 110.304 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.645 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 36.9 ttm180 -66.63 -50.92 61.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.066 . . . . 0.0 111.004 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.1 m -55.88 -50.99 69.13 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.967 -1.093 . . . . 0.0 109.026 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -64.31 -43.67 93.99 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.093 -1.005 . . . . 0.0 111.503 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.75 -41.01 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.274 -1.516 . . . . 0.0 108.859 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.908 ' SD ' HD21 ' A' ' 122' ' ' LEU . 42.9 mmm -51.97 -59.49 4.28 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.677 -0.639 . . . . 0.0 111.357 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -50.38 21.37 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.543 -1.348 . . . . 0.0 113.196 -177.372 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 106' ' ' LEU . 57.6 m-85 -82.0 -47.0 13.19 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -174.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.65 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.3 mp -104.28 6.19 35.2 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.394 -1.441 . . . . 0.0 114.044 -176.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.507 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 48.1 t80 -65.05 -40.29 44.56 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 119.892 -1.755 . . . . 0.0 111.475 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 83.5 Cg_endo -77.79 -40.98 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 121.687 1.591 . . . . 0.0 113.317 -179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.59 -43.52 89.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.884 -1.135 . . . . 0.0 108.109 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -68.27 -54.61 16.36 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.517 -0.739 . . . . 0.0 109.932 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' A' ' 115' ' ' ASN . 91.8 m -70.62 -43.15 69.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.866 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.475 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 40.0 tp10 -67.09 -49.5 64.82 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.715 -1.24 . . . . 0.0 110.83 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -76.18 -27.28 56.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.044 -1.035 . . . . 0.0 111.036 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HG2' HD21 ' A' ' 116' ' ' LEU . 43.6 tptt -125.12 -27.3 3.55 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.974 -1.079 . . . . 0.0 111.954 -177.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.568 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.4 t30 58.72 45.23 16.05 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.523 -1.361 . . . . 0.0 110.376 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.494 HD11 HG23 ' A' ' 64' ' ' ILE . 87.4 mt -67.82 -32.0 72.25 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.037 -1.04 . . . . 0.0 110.871 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.47 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 26.0 t -153.23 -167.71 2.8 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 119.009 -1.076 . . . . 0.0 111.292 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 81.2 p -124.5 161.61 47.14 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.605 -0.684 . . . . 0.0 110.137 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.507 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 23.3 Cg_exo -59.83 -40.97 58.53 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.602 1.535 . . . . 0.0 112.36 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.77 -37.11 86.15 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.143 -0.973 . . . . 0.0 109.871 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.47 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.69 -46.19 73.01 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.908 HD21 ' SD ' ' A' ' 103' ' ' MET . 11.4 tp -66.47 -52.08 49.96 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.485 -0.759 . . . . 0.0 109.879 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.25 -45.84 87.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.129 -0.982 . . . . 0.0 109.629 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.41 87.78 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.25 -0.906 . . . . 0.0 109.873 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.33 -33.33 74.11 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.231 -0.918 . . . . 0.0 108.907 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.595 HD11 ' SD ' ' A' ' 103' ' ' MET . 8.0 mt -65.44 -48.96 81.05 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -64.0 -38.72 92.1 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.446 -0.784 . . . . 0.0 109.138 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.5 -34.08 84.17 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.645 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 9.8 p30 -95.14 -35.19 11.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.122 -1.222 . . . . 0.0 110.598 -179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.537 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 53.7 mtp180 . . . . . 0 N--CA 1.494 1.735 0 O-C-N 120.75 -1.218 . . . . 0.0 109.69 178.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.761 ' O ' HG13 ' A' ' 13' ' ' VAL . 2.8 mp0 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.182 0.515 . . . . 0.0 109.851 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.31 -50.9 68.39 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.121 -0.987 . . . . 0.0 109.811 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -62.03 -45.08 95.17 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.09 -1.006 . . . . 0.0 109.66 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -63.71 -47.84 79.52 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.378 -0.826 . . . . 0.0 110.278 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.761 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -72.78 -36.46 52.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 O-C-N 120.644 -1.285 . . . . 0.0 108.567 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.43 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -56.93 -40.16 75.85 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.492 -1.38 . . . . 0.0 107.761 178.363 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -58.79 -30.47 67.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.431 -0.908 . . . . 0.0 108.607 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.459 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.1 mt -71.72 -39.18 70.31 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.415 -0.803 . . . . 0.0 111.661 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -76.47 -32.83 58.61 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.402 -1.436 . . . . 0.0 110.29 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.467 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -66.52 -25.85 66.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.899 -1.126 . . . . 0.0 110.386 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 HH21 ' A' ' 25' ' ' ARG . 30.3 mt -38.96 -39.72 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 O-C-N 121.605 -0.684 . . . . 0.0 110.397 -179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.2 m120 -171.33 161.84 6.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.739 -1.226 . . . . 0.0 110.315 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -90.5 65.16 6.02 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.47 0.653 . . . . 0.0 109.3 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -111.9 103.22 55.04 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.502 -0.749 . . . . 0.0 109.136 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -47.83 -43.47 29.2 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.015 1.81 . . . . 0.0 111.957 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -61.62 -38.48 87.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.19 -0.944 . . . . 0.0 108.535 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.679 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -60.36 -44.53 95.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.5 -0.75 . . . . 0.0 109.389 179.89 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.3 -53.54 53.59 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 0.0 109.77 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -52.74 -39.05 61.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.432 -0.793 . . . . 0.0 109.175 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -61.12 -63.01 1.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.325 -0.859 . . . . 0.0 109.858 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.585 HD11 ' NH1' ' A' ' 25' ' ' ARG . 43.7 mt -56.2 -44.72 79.75 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.585 -0.697 . . . . 0.0 109.521 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -61.93 -46.53 88.94 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.704 -0.798 . . . . 0.0 109.121 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -66.59 -42.91 86.21 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.7 tp -61.07 -49.3 77.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 0.0 110.658 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -60.43 -36.44 78.19 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.284 -1.51 . . . . 0.0 107.528 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.3 t -69.93 -53.27 18.64 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.508 -0.745 . . . . 0.0 109.478 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 76.6 t80 -58.73 -42.38 88.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 111.17 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.446 ' CE ' ' O ' ' A' ' 41' ' ' THR . 63.4 mmm -56.49 -38.2 71.41 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.142 -0.974 . . . . 0.0 110.915 -178.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -55.68 -40.18 71.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.765 -1.209 . . . . 0.0 108.499 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -64.91 -39.54 93.67 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.884 0.85 . . . . 0.0 108.739 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.406 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 21.8 mmm180 -64.31 -30.52 71.57 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.522 -0.736 . . . . 0.0 109.265 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.26 -0.83 60.3 Favored Glycine 0 N--CA 1.485 1.948 0 N-CA-C 108.152 -1.979 . . . . 0.0 108.152 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.446 ' O ' ' CE ' ' A' ' 36' ' ' MET . 44.9 p -120.27 84.37 34.44 Favored Pre-proline 0 N--CA 1.488 1.445 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.76 141.93 11.1 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.439 2.093 . . . . 0.0 110.915 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.4 mt -78.8 101.23 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 120.928 -1.107 . . . . 0.0 110.159 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -82.91 -4.09 57.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.626 ' NE ' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -170.4 124.45 0.71 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.583 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.43 HD22 HD11 ' A' ' 16' ' ' LEU . 2.3 mt -73.09 147.56 88.3 Favored Pre-proline 0 C--N 1.291 -1.971 0 O-C-N 121.412 -0.805 . . . . 0.0 109.243 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -73.78 133.45 18.57 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.526 1.484 . . . . 0.0 108.999 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 42.2 mt -101.0 142.51 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.777 -1.202 . . . . 0.0 110.509 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.744 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.0 mtp -135.07 121.69 20.72 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.585 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.48 41.42 3.2 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -178.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 56.94 22.84 7.58 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.369 0.604 . . . . 0.0 109.681 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -132.79 148.44 52.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.399 -0.813 . . . . 0.0 109.14 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 10.2 m -67.0 145.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.895 -1.128 . . . . 0.0 108.955 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.744 HD13 ' SD ' ' A' ' 49' ' ' MET . 36.9 tp -77.11 122.57 25.17 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.307 -0.871 . . . . 0.0 109.795 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -65.84 90.96 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.525 -0.735 . . . . 0.0 109.565 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.3 -24.33 28.08 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 120.877 -1.139 . . . . 0.0 109.438 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.742 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 43.6 t80 -77.98 -59.35 2.82 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.227 -0.92 . . . . 0.0 111.654 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -60.22 -38.36 83.15 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.834 -1.166 . . . . 0.0 110.615 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.499 HD13 HD22 ' A' ' 98' ' ' LEU . 32.1 tp -58.5 -45.03 89.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 43.7 t80 -57.04 -68.43 0.23 Allowed 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.742 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 7.9 m-20 -39.91 -42.21 1.3 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.613 -0.679 . . . . 0.0 111.142 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.609 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.7 mt -69.47 -44.31 71.44 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.116 -1.433 . . . . 0.0 107.314 179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.811 HG21 ' CE2' ' A' ' 102' ' ' TYR . 34.8 t -58.43 -44.04 87.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 121.261 -0.9 . . . . 0.0 110.288 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.545 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 1.2 mm -69.42 -34.11 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.386 -1.446 . . . . 0.0 107.986 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.11 28.02 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 120.096 -0.641 . . . . 0.0 109.562 -178.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.632 HH21 ' CB ' ' A' ' 80' ' ' GLU . 7.5 mmt-85 -92.95 -4.39 52.81 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.678 -1.264 . . . . 0.0 108.898 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 19.05 62.63 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.058 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.23 128.17 2.19 Favored Glycine 0 N--CA 1.5 2.942 0 O-C-N 120.342 -1.681 . . . . 0.0 111.815 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 102' ' ' TYR . 8.1 tp -48.93 -39.34 25.87 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.601 -0.941 . . . . 0.0 109.723 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' A' ' 122' ' ' LEU . 92.8 t -58.82 -43.11 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 109.805 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -56.01 -40.78 73.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.0 109.208 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 48.0 t -60.97 -43.95 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.392 -0.818 . . . . 0.0 109.216 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 88.4 mt -66.57 -56.36 14.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 O-C-N 121.043 -1.036 . . . . 0.0 110.572 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.75 -42.83 79.98 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.991 -1.068 . . . . 0.0 110.322 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -93.28 -8.97 40.63 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.089 -1.007 . . . . 0.0 110.223 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 24.3 mtmm 57.93 60.71 2.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 0.0 109.387 -178.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.0 mt -91.2 14.76 13.39 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.466 ' CE2' HG12 ' A' ' 72' ' ' VAL . 83.0 m95 -63.73 -39.79 95.17 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.389 -0.82 . . . . 0.0 109.132 179.199 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 78' ' ' TRP . 77.6 mm-40 -50.49 -39.09 47.45 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.456 -1.403 . . . . 0.0 108.252 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.632 ' CB ' HH21 ' A' ' 66' ' ' ARG . 97.6 mt-10 -69.62 -43.14 73.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.45 -51.96 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 95' ' ' ALA . 85.6 mt -52.36 -51.59 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -0.884 . . . . 0.0 108.866 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.11 -41.63 85.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.198 -0.939 . . . . 0.0 109.688 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.05 -31.53 40.55 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.3 mt -89.38 -8.83 52.31 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.477 -1.014 . . . . 0.0 109.004 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 61.49 40.4 13.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -73.46 141.15 79.7 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.8 Cg_endo -67.48 138.37 45.81 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 121.884 1.723 . . . . 0.0 112.155 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.7 t -56.1 -0.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.297 -0.877 . . . . 0.0 110.035 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 16.0 m -64.87 -30.82 71.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 109.718 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.585 HD11 ' H ' ' A' ' 50' ' ' ALA . 68.7 mt -93.22 101.32 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.923 -1.111 . . . . 0.0 109.406 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -72.79 -28.02 62.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.076 -1.015 . . . . 0.0 108.662 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.4 m -89.56 30.05 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.409 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -60.06 -65.35 0.69 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.761 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.59 -52.62 29.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.451 -0.78 . . . . 0.0 109.607 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.79 -43.99 90.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.872 -1.142 . . . . 0.0 109.304 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 m -60.17 -38.63 83.79 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.097 -1.002 . . . . 0.0 108.597 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.499 HD22 HD13 ' A' ' 59' ' ' LEU . 9.8 mt -70.8 -46.5 62.72 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.614 -0.678 . . . . 0.0 109.85 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.682 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -65.87 -51.35 59.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 111.179 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.5 m -55.94 -53.39 57.39 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 110.108 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -63.09 -41.14 99.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.171 -0.956 . . . . 0.0 111.273 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.811 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.8 t80 -57.03 -41.44 78.62 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.112 -1.617 . . . . 0.0 109.447 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.608 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -55.94 -55.54 31.4 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.387 -0.82 . . . . 0.0 112.157 -178.612 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -70.94 -53.27 15.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 120.84 -1.163 . . . . 0.0 112.702 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.483 ' C ' HD12 ' A' ' 106' ' ' LEU . 55.7 m-85 -84.31 -44.6 13.67 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -175.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.1 mp -102.96 6.4 38.89 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.36 -1.463 . . . . 0.0 113.913 -176.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.576 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 49.0 t80 -62.42 -42.79 82.14 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 119.855 -1.778 . . . . 0.0 111.625 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 112' ' ' GLU . 95.4 Cg_endo -76.96 -41.87 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 121.473 1.448 . . . . 0.0 112.823 -178.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -57.32 -38.97 74.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.82 -1.175 . . . . 0.0 107.981 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.491 ' O ' ' OE1' ' A' ' 110' ' ' GLU . 4.7 tp10 -73.5 -54.8 7.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.608 -0.682 . . . . 0.0 110.282 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.577 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.1 m -73.02 -41.42 64.26 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.318 -0.864 . . . . 0.0 111.16 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.64 -44.8 80.99 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.706 -1.246 . . . . 0.0 110.587 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -74.66 -33.63 62.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.195 -0.941 . . . . 0.0 111.253 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HG2' HD21 ' A' ' 116' ' ' LEU . 4.1 tppt? -125.18 -24.37 4.01 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.938 -1.101 . . . . 0.0 111.773 -177.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 111' ' ' CYS . 17.3 t-20 57.01 44.94 21.97 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.631 -1.293 . . . . 0.0 110.23 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.6 mt -67.5 -29.62 69.09 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.089 -1.007 . . . . 0.0 110.828 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 118' ' ' THR . 46.5 t -152.66 -169.0 3.21 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.355 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.431 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.4 p -128.84 166.79 22.44 Favored Pre-proline 0 N--CA 1.498 1.974 0 O-C-N 121.593 -0.692 . . . . 0.0 109.61 -178.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -62.88 -40.4 35.54 Favored 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 121.382 1.388 . . . . 0.0 111.908 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.53 87.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.064 -1.023 . . . . 0.0 109.306 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.46 -45.63 79.08 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 178.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.608 HD21 ' HG3' ' A' ' 103' ' ' MET . 29.3 tp -66.17 -51.03 61.73 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.352 -0.842 . . . . 0.0 109.972 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -57.26 -46.99 82.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.081 -1.012 . . . . 0.0 109.647 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.498 ' O ' ' OD1' ' A' ' 127' ' ' ASP . . . -61.1 -41.02 95.91 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.299 -0.876 . . . . 0.0 110.082 -179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.63 -34.36 75.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 108.417 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.505 ' HA ' ' ND2' ' A' ' 129' ' ' ASN . 10.5 mt -63.94 -49.99 79.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.677 ' OD1' ' N ' ' A' ' 128' ' ' GLY . 18.9 p30 -65.75 -32.58 74.21 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 118.863 -1.135 . . . . 0.0 108.588 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.677 ' N ' ' OD1' ' A' ' 127' ' ' ASP . . . -65.61 -30.23 76.92 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.682 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 3.3 p30 -90.69 -35.99 14.6 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.004 -1.291 . . . . 0.0 110.741 -179.082 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.495 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 72.6 mtm180 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 120.783 -1.198 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.86 ' O ' HG12 ' A' ' 13' ' ' VAL . 37.3 mt-30 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -48.24 -47.27 35.93 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.476 -0.765 . . . . 0.0 109.606 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -62.14 -41.85 98.67 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.162 -0.961 . . . . 0.0 108.687 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.78 -52.95 38.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.683 -0.635 . . . . 0.0 111.454 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.86 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.9 OUTLIER -71.47 -37.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.989 -1.069 . . . . 0.0 109.959 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.405 ' HB2' ' HE ' ' A' ' 14' ' ' ARG . 6.1 tpp180 -60.19 -39.5 86.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.083 -1.636 . . . . 0.0 108.214 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -58.3 -30.71 66.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.598 HD13 HD22 ' A' ' 29' ' ' LEU . 10.9 mt -68.08 -39.46 82.92 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.457 -0.777 . . . . 0.0 111.529 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 90.8 m-85 -77.52 -37.67 50.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.357 -1.464 . . . . 0.0 110.289 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.488 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.1 -27.82 69.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.119 -0.988 . . . . 0.0 111.132 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.644 HD13 ' NH2' ' A' ' 25' ' ' ARG . 16.5 mt -36.1 -40.18 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.592 -0.693 . . . . 0.0 110.578 -178.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.402 HD22 HH11 ' A' ' 25' ' ' ARG . 50.2 p30 -172.69 167.74 5.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.836 -1.165 . . . . 0.0 110.356 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 53.6 p30 -90.53 65.39 6.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.575 -0.703 . . . . 0.0 110.707 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.89 136.01 19.6 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.955 . . . . 0.0 108.46 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.503 ' O ' ' OE1' ' A' ' 27' ' ' GLU . 67.4 Cg_endo -75.72 -62.61 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.049 1.833 . . . . 0.0 112.656 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -55.02 -36.82 65.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.416 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.644 ' NH2' HD13 ' A' ' 19' ' ' ILE . 57.9 ttt180 -57.31 -38.42 73.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.221 -0.924 . . . . 0.0 109.765 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -60.12 -58.48 8.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.963 . . . . 0.0 109.763 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.503 ' OE1' ' O ' ' A' ' 23' ' ' PRO . 44.2 mp0 -53.4 -33.65 54.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.321 -0.862 . . . . 0.0 109.995 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -60.96 -63.19 1.38 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.155 -0.965 . . . . 0.0 110.896 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.598 HD22 HD13 ' A' ' 16' ' ' LEU . 28.1 mt -56.17 -45.44 79.72 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.037 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 38.4 m-20 -62.41 -46.21 89.62 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.599 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.95 -44.39 80.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.223 -0.923 . . . . 0.0 109.782 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.2 tp -56.51 -47.88 78.41 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 110.267 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.468 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.3 m-85 -61.23 -34.74 75.6 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.311 -1.356 . . . . 0.0 108.385 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 m -69.25 -55.13 11.43 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.274 -0.891 . . . . 0.0 110.457 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 43.0 t80 -60.36 -37.2 79.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.869 . . . . 0.0 110.921 -179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.5 mmm -59.44 -37.61 78.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.17 -0.956 . . . . 0.0 110.867 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -62.93 -39.76 95.56 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.962 -1.086 . . . . 0.0 110.82 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -63.39 -36.99 85.53 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.655 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -65.03 -29.04 69.91 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.386 -179.286 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.71 -1.76 63.97 Favored Glycine 0 C--N 1.295 -1.717 0 N-CA-C 107.44 -2.264 . . . . 0.0 107.44 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.4 p -116.93 84.02 15.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -86.59 143.18 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.684 2.256 . . . . 0.0 110.575 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.503 HG21 HD23 ' A' ' 46' ' ' LEU . 20.3 mt -78.73 99.44 3.09 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 120.866 -1.146 . . . . 0.0 109.389 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.481 ' HB3' HH12 ' A' ' 45' ' ' ARG . 89.7 m-20 -67.59 -38.11 83.55 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 178.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.642 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -144.28 130.56 19.72 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 178.938 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD23 HG21 ' A' ' 43' ' ' ILE . 7.3 mt -71.46 147.61 92.72 Favored Pre-proline 0 C--N 1.298 -1.647 0 O-C-N 121.287 -0.883 . . . . 0.0 109.504 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.41 138.69 33.25 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 121.685 1.59 . . . . 0.0 109.429 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.501 HG23 ' N ' ' A' ' 52' ' ' SER . 41.3 mt -104.41 143.14 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.044 -1.035 . . . . 0.0 110.379 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.618 ' SD ' HG21 ' A' ' 97' ' ' THR . 76.7 mmm -135.35 127.3 29.56 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.58 42.47 17.29 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.2 mttt 59.72 25.62 14.62 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.415 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.501 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.35 154.71 48.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.1 -1.0 . . . . 0.0 109.794 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.7 m -67.16 144.24 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 120.939 -1.101 . . . . 0.0 109.263 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.509 HD21 HD22 ' A' ' 59' ' ' LEU . 60.1 tp -77.59 123.95 27.29 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.533 -0.73 . . . . 0.0 109.848 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.55 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.8 m-20 -66.28 90.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.339 -0.851 . . . . 0.0 109.437 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.95 -23.03 11.68 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.053 -1.029 . . . . 0.0 109.174 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.442 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 46.5 t80 -78.91 -58.95 2.98 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.228 -0.92 . . . . 0.0 111.618 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -58.61 -36.46 74.05 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.661 -1.275 . . . . 0.0 109.898 -178.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 54' ' ' LEU . 62.0 tp -62.77 -43.0 99.94 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.444 ' CE2' HG13 ' A' ' 64' ' ' ILE . 60.7 t80 -61.16 -69.94 0.21 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.815 -0.553 . . . . 0.0 109.56 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' A' ' 57' ' ' TYR . 5.5 m120 -42.73 -37.24 1.69 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.323 -0.86 . . . . 0.0 109.732 -179.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.506 HD13 ' HA ' ' A' ' 81' ' ' ILE . 9.5 mt -67.33 -51.8 48.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.856 HG21 ' CE2' ' A' ' 102' ' ' TYR . 38.8 t -57.92 -43.99 85.72 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.702 -0.624 . . . . 0.0 109.605 179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.506 HD12 ' OE1' ' A' ' 110' ' ' GLU . 14.2 mm -69.06 -37.88 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -17.55 32.76 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 120.269 -0.573 . . . . 0.0 109.794 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.681 ' HG3' HD13 ' A' ' 77' ' ' LEU . 7.5 mpt_? -97.87 4.35 49.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.838 -1.164 . . . . 0.0 109.361 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.61 12.32 80.36 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.107 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 133.2 138.33 4.03 Favored Glycine 0 N--CA 1.504 3.202 0 O-C-N 120.512 -1.581 . . . . 0.0 111.701 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 102' ' ' TYR . 7.5 tp -50.75 -43.07 58.13 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.766 -0.844 . . . . 0.0 111.349 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.8 t -60.03 -42.16 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 120.73 -1.231 . . . . 0.0 110.062 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -55.43 -37.98 68.38 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.012 -1.055 . . . . 0.0 109.313 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 76' ' ' LYS . 54.5 t -64.3 -43.62 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.584 -0.698 . . . . 0.0 109.936 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.5 mt -66.34 -58.2 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.854 -1.153 . . . . 0.0 110.987 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 88.7 m-20 -57.12 -41.48 79.08 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.034 -1.041 . . . . 0.0 110.344 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -93.06 -10.57 35.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.95 . . . . 0.0 110.608 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.598 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.8 mttp 59.18 60.6 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -0.825 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' A' ' 66' ' ' ARG . 13.7 mt -91.43 13.39 17.69 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.911 -1.118 . . . . 0.0 108.107 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.476 ' CE2' HG12 ' A' ' 72' ' ' VAL . 85.1 m95 -63.05 -41.32 99.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.352 -0.842 . . . . 0.0 109.398 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 99.3 mm-40 -50.62 -36.7 36.52 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 118.054 -1.458 . . . . 0.0 108.112 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.0 mm-40 -71.17 -43.34 67.66 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.506 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.0 mt -67.8 -54.16 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.541 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.3 mt -53.13 -54.58 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -67.79 -40.55 83.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.174 -0.954 . . . . 0.0 109.32 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.38 -32.22 44.5 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.6 mt -89.57 -7.73 54.22 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.469 -1.018 . . . . 0.0 108.631 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.8 m80 65.12 40.8 4.85 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.308 0.575 . . . . 0.0 110.097 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 30.1 mt -72.47 148.77 90.81 Favored Pre-proline 0 N--CA 1.489 1.477 0 O-C-N 121.219 -0.926 . . . . 0.0 108.955 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.49 164.61 33.62 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.328 2.019 . . . . 0.0 112.129 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.8 m -82.66 -0.03 45.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.0 108.855 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 m -65.49 -33.4 75.83 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.601 -0.687 . . . . 0.0 110.235 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.419 HD13 ' SD ' ' A' ' 49' ' ' MET . 89.3 mt -91.51 100.43 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.672 -1.267 . . . . 0.0 109.312 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 67.1 p -72.24 -23.32 61.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.272 -0.892 . . . . 0.0 109.139 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.0 m -101.55 40.67 1.28 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.492 -0.755 . . . . 0.0 109.156 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -63.08 1.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 108.853 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.541 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.36 -50.91 15.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.539 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.71 -42.47 88.75 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.788 -1.195 . . . . 0.0 109.171 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.618 HG21 ' SD ' ' A' ' 49' ' ' MET . 19.7 m -62.42 -41.17 98.5 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.127 -0.983 . . . . 0.0 108.819 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.455 HD22 HD13 ' A' ' 59' ' ' LEU . 8.5 mt -69.57 -48.35 60.58 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.722 -0.611 . . . . 0.0 109.816 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.711 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -63.35 -51.08 67.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.239 -0.913 . . . . 0.0 110.974 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.5 m -55.64 -55.12 35.8 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.236 -0.915 . . . . 0.0 109.792 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -63.3 -42.02 99.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -0.887 . . . . 0.0 111.477 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.856 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -57.83 -40.94 81.21 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.278 -1.514 . . . . 0.0 109.321 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.587 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -53.01 -56.85 12.98 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.555 -0.715 . . . . 0.0 111.566 -178.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mttm -74.58 -52.65 11.22 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.871 -1.143 . . . . 0.0 113.151 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.25 -47.76 11.19 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 106' ' ' LEU . 11.2 mp -97.11 -3.2 41.61 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.169 -1.582 . . . . 0.0 113.4 -176.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 74.8 t80 -64.14 -35.77 16.72 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 119.981 -1.699 . . . . 0.0 109.876 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 25.7 Cg_exo -63.6 -55.13 0.75 Allowed 'Trans proline' 0 N--CA 1.5 1.888 0 C-N-CA 122.427 2.085 . . . . 0.0 112.545 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.82 -46.14 85.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.42 -0.8 . . . . 0.0 109.212 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLU . . . . . 0.506 ' OE1' HD12 ' A' ' 64' ' ' ILE . 3.4 tp10 -66.25 -53.57 35.33 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.317 -0.864 . . . . 0.0 109.727 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.6 t -67.24 -45.38 76.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 110.353 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -67.26 -48.91 66.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.165 -0.96 . . . . 0.0 111.379 -178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -73.57 -32.45 64.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.107 -0.996 . . . . 0.0 112.246 -177.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HG2' HD21 ' A' ' 116' ' ' LEU . 2.2 tppt? -125.18 -27.54 3.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.888 -1.132 . . . . 0.0 111.854 -177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 55.59 45.47 24.77 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.742 -1.224 . . . . 0.0 110.528 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.538 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.9 mt -68.05 -28.39 67.34 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.029 -1.044 . . . . 0.0 110.943 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -152.49 -167.01 2.63 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 118.733 -1.187 . . . . 0.0 111.607 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.534 ' N ' ' OG ' ' A' ' 117' ' ' SER . 76.7 p -131.41 158.55 74.98 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.661 -0.649 . . . . 0.0 109.914 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.11 -40.4 86.01 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.671 1.581 . . . . 0.0 112.437 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.77 -38.9 92.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.782 -1.199 . . . . 0.0 109.788 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.417 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.6 mt-10 -65.09 -41.06 95.34 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.587 HD21 ' HG3' ' A' ' 103' ' ' MET . 20.2 tp -69.36 -50.34 47.18 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.684 -0.635 . . . . 0.0 110.219 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -58.35 -46.55 86.03 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.054 -1.028 . . . . 0.0 109.729 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.32 -42.34 98.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.373 -0.829 . . . . 0.0 110.408 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.12 -33.5 74.62 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.087 -1.008 . . . . 0.0 108.429 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.502 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.3 mt -64.67 -49.52 79.95 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.962 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.51 -38.22 86.57 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.78 75.82 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.711 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 29.6 p30 -94.13 -28.25 15.79 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.266 -1.137 . . . . 0.0 110.456 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.1 mtp180 . . . . . 0 N--CA 1.494 1.742 0 O-C-N 120.766 -1.209 . . . . 0.0 109.491 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.908 ' O ' HG12 ' A' ' 13' ' ' VAL . 3.5 mm100 . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -50.91 -47.44 60.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 0.0 109.535 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -61.36 -42.28 98.45 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.179 -0.951 . . . . 0.0 109.469 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -67.0 -51.53 53.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.179 -0.95 . . . . 0.0 111.194 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.908 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -71.74 -39.61 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.256 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -58.92 -38.9 80.02 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.099 -1.626 . . . . 0.0 108.155 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -60.71 -31.32 70.61 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.648 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.547 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.4 mt -64.55 -39.15 93.23 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 110.734 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.412 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -79.57 -34.98 40.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.561 -1.337 . . . . 0.0 109.835 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.44 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.7 mt-10 -64.8 -29.22 70.18 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.063 -1.023 . . . . 0.0 110.601 -178.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.53 HD12 ' HA ' ' A' ' 16' ' ' LEU . 16.5 mt -37.82 -39.94 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.518 -0.739 . . . . 0.0 110.897 -178.675 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 0.9 OUTLIER -173.02 164.97 4.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.649 -1.282 . . . . 0.0 110.677 -179.159 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -92.14 67.18 4.99 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.838 -0.539 . . . . 0.0 110.078 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.33 102.87 54.14 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.36 -48.83 14.25 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.952 1.768 . . . . 0.0 112.341 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 24' ' ' LYS . 0.9 OUTLIER -61.04 -37.1 81.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.996 -1.065 . . . . 0.0 108.919 179.421 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.642 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.2 ttt-85 -60.33 -42.89 96.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.306 -0.871 . . . . 0.0 109.439 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -62.22 -52.61 63.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.991 -1.068 . . . . 0.0 109.644 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -52.26 -35.04 48.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 0.0 109.288 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.98 -62.69 1.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.639 0.733 . . . . 0.0 110.549 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.547 HD13 ' HB3' ' A' ' 16' ' ' LEU . 14.6 mt -57.38 -43.21 83.42 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.643 -0.661 . . . . 0.0 109.365 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.412 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 96.5 m-20 -58.94 -50.75 72.88 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.211 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -66.99 -44.03 81.44 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.341 -0.85 . . . . 0.0 110.333 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.4 tp -57.96 -50.42 73.44 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.94 . . . . 0.0 110.381 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -60.85 -34.23 74.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.154 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -67.03 -54.66 19.49 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.336 -0.852 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.53 -38.98 86.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.661 -179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mmm -59.47 -39.41 83.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 111.512 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.427 ' NE2' ' HB3' ' A' ' 42' ' ' PRO . 85.2 mm-40 -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.739 -1.225 . . . . 0.0 110.783 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 52.9 mttt -64.96 -44.05 90.66 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.031 -1.043 . . . . 0.0 109.509 -179.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.47 HH11 ' HB3' ' A' ' 108' ' ' PRO . 7.8 mtp180 -63.2 -25.47 68.35 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.963 -177.459 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.21 0.23 55.91 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 107.977 -2.049 . . . . 0.0 107.977 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 50.1 p -115.61 83.9 11.74 Favored Pre-proline 0 N--CA 1.49 1.56 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 70.7 Cg_endo -85.08 142.73 8.86 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.647 2.232 . . . . 0.0 111.084 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.502 HG21 HD23 ' A' ' 46' ' ' LEU . 45.2 mt -78.88 94.53 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 C-N-CA 118.795 -1.162 . . . . 0.0 109.329 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.446 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 82.1 m-20 -65.97 -32.89 74.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -151.23 133.28 15.16 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.502 HD23 HG21 ' A' ' 43' ' ' ILE . 13.1 mt -71.45 146.76 92.08 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 120.784 -1.197 . . . . 0.0 109.267 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.54 104.16 1.76 Allowed 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 121.636 1.558 . . . . 0.0 109.735 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.2 mt -72.7 142.4 15.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.082 -1.011 . . . . 0.0 110.202 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.815 ' SD ' HG21 ' A' ' 97' ' ' THR . 64.9 mmm -138.51 127.96 24.61 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.782 0.801 . . . . 0.0 108.972 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.522 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 63.32 40.04 8.94 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 -178.149 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 59.42 22.62 11.1 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.321 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.8 m -137.1 155.4 49.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.182 -0.949 . . . . 0.0 109.512 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 m -65.82 143.4 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.81 -1.181 . . . . 0.0 108.836 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 59' ' ' LEU . 42.1 tp -77.76 124.45 27.97 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.17 -0.956 . . . . 0.0 109.135 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -65.17 91.64 0.1 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.569 -0.707 . . . . 0.0 110.045 -178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.3 mt -53.89 -25.14 18.59 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 120.99 -1.068 . . . . 0.0 108.848 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.48 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 46.9 t80 -79.38 -57.85 3.5 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 111.685 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.13 -39.25 91.92 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.659 -1.276 . . . . 0.0 110.153 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 54' ' ' LEU . 60.7 tp -60.02 -40.98 91.15 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.829 -1.169 . . . . 0.0 108.352 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -61.56 -67.17 0.43 Allowed 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.48 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 88.0 m-20 -43.06 -39.75 2.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.482 -0.761 . . . . 0.0 111.123 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -70.21 -46.58 64.25 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 117.656 -1.618 . . . . 0.0 107.356 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.902 HG21 ' CE2' ' A' ' 102' ' ' TYR . 33.8 t -57.61 -44.49 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 110.566 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.499 HG23 HD11 ' A' ' 116' ' ' LEU . 10.9 mm -70.16 -34.2 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 120.508 -1.37 . . . . 0.0 108.007 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.18 -20.44 26.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.82 -0.55 . . . . 0.0 110.232 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.587 HH21 ' CB ' ' A' ' 80' ' ' GLU . 14.6 mmt-85 -94.53 2.07 55.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.713 -1.242 . . . . 0.0 108.732 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.97 14.4 77.37 Favored Glycine 0 N--CA 1.493 2.438 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.154 177.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.61 2.96 Favored Glycine 0 N--CA 1.501 2.974 0 O-C-N 120.519 -1.577 . . . . 0.0 111.316 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.503 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.7 tp -50.11 -40.91 47.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.65 -0.912 . . . . 0.0 110.754 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.549 HG22 ' HA ' ' A' ' 122' ' ' LEU . 76.3 t -58.99 -41.54 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.903 -1.123 . . . . 0.0 109.863 -179.02 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -56.4 -39.84 73.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.995 -1.065 . . . . 0.0 108.877 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 76' ' ' LYS . 98.2 t -64.99 -44.26 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.544 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.402 HD12 ' CD1' ' A' ' 122' ' ' LEU . 43.8 mt -67.44 -52.54 40.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.821 0 O-C-N 120.862 -1.149 . . . . 0.0 110.01 -178.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -57.73 -42.97 84.95 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.995 -1.066 . . . . 0.0 110.35 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -94.94 -8.88 35.75 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 72' ' ' VAL . 37.7 mtmt 59.04 60.69 2.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.338 -0.851 . . . . 0.0 109.703 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.413 HD13 ' HD2' ' A' ' 66' ' ' ARG . 14.7 mt -90.9 17.63 7.59 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.503 ' CH2' HD11 ' A' ' 69' ' ' LEU . 97.9 m95 -64.48 -43.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.537 179.245 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 78' ' ' TRP . 50.8 mt-30 -48.21 -38.83 19.31 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.254 -1.379 . . . . 0.0 108.35 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.587 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.0 mm-40 -66.39 -40.79 89.87 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -72.41 -52.32 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.568 HD11 ' HB2' ' A' ' 95' ' ' ALA . 45.9 mt -52.96 -52.55 27.86 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -72.3 -40.7 67.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.479 -0.763 . . . . 0.0 109.899 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.75 -34.87 45.24 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.8 mt -89.71 -7.96 53.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -1.075 . . . . 0.0 108.888 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 67.22 38.5 3.33 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.34 0.591 . . . . 0.0 109.546 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.66 120.08 78.73 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.407 -0.808 . . . . 0.0 108.967 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.481 ' C ' ' H ' ' A' ' 90' ' ' SER . 50.8 Cg_exo -47.79 139.16 19.51 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.767 1.645 . . . . 0.0 112.694 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 83.4 p -60.84 0.91 0.17 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.344 -0.848 . . . . 0.0 109.887 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.481 ' H ' ' C ' ' A' ' 88' ' ' PRO . 6.0 m -62.7 -33.04 74.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.146 -0.971 . . . . 0.0 109.503 -178.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.522 HD11 ' H ' ' A' ' 50' ' ' ALA . 85.7 mt -87.2 101.12 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.826 -1.171 . . . . 0.0 108.937 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 39.1 p -68.18 -29.31 68.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.311 -0.868 . . . . 0.0 109.132 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -94.79 39.96 1.1 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.53 -0.731 . . . . 0.0 109.067 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.77 -64.62 0.86 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.14 -0.975 . . . . 0.0 108.931 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.568 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.98 24.22 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.342 -0.849 . . . . 0.0 109.6 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.519 HD12 ' NH2' ' A' ' 99' ' ' ARG . 6.8 tp -58.61 -47.38 84.52 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.732 -1.23 . . . . 0.0 109.628 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.815 HG21 ' SD ' ' A' ' 49' ' ' MET . 58.1 m -59.51 -40.1 86.02 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.032 -1.043 . . . . 0.0 108.842 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.404 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.6 mt -71.05 -45.45 63.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.659 -0.651 . . . . 0.0 110.255 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.519 ' NH2' HD12 ' A' ' 96' ' ' LEU . 9.1 tmm_? -67.28 -50.67 59.42 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.841 -1.162 . . . . 0.0 110.952 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.3 m -55.99 -54.8 40.52 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.163 -0.961 . . . . 0.0 110.081 -178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -61.99 -40.57 96.07 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.105 -0.997 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.902 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.8 t80 -57.58 -39.82 77.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.21 -1.556 . . . . 0.0 109.402 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' MET . . . . . 0.572 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.7 ttm -55.58 -55.94 26.16 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.393 -0.817 . . . . 0.0 112.246 -178.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -72.85 -52.05 16.34 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.627 -1.296 . . . . 0.0 112.823 -176.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.505 ' C ' HD12 ' A' ' 106' ' ' LEU . 58.6 m-85 -83.69 -43.19 15.8 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -175.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -99.63 -7.25 26.0 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.283 -1.511 . . . . 0.0 114.238 -176.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.652 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 46.5 t80 -62.3 -36.92 31.94 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 119.686 -1.884 . . . . 0.0 109.727 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.652 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.9 Cg_exo -65.69 -56.81 0.29 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.242 1.961 . . . . 0.0 112.091 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.31 -35.93 74.7 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -71.8 -56.21 6.17 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.732 -0.605 . . . . 0.0 110.309 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.5 OUTLIER -69.96 -41.53 74.36 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.304 -0.872 . . . . 0.0 110.1 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 45.4 tp10 -66.57 -49.52 66.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.261 -0.9 . . . . 0.0 110.799 -178.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -74.67 -30.22 61.52 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.088 -1.008 . . . . 0.0 111.513 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG2' HD21 ' A' ' 116' ' ' LEU . 40.2 tptt -125.35 -27.63 3.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.004 -1.06 . . . . 0.0 112.115 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' A' ' 111' ' ' CYS . 29.9 t30 57.04 45.42 21.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.579 -1.326 . . . . 0.0 110.065 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.499 HD11 HG23 ' A' ' 64' ' ' ILE . 78.7 mt -67.55 -33.24 74.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.116 -0.99 . . . . 0.0 111.431 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.568 ' OG ' ' N ' ' A' ' 118' ' ' THR . 27.6 t -154.28 -166.11 2.27 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.598 -1.241 . . . . 0.0 111.75 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.568 ' N ' ' OG ' ' A' ' 117' ' ' SER . 81.9 p -124.67 152.24 68.88 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.888 -0.508 . . . . 0.0 109.754 -178.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.66 -38.71 91.08 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.2 1.933 . . . . 0.0 112.326 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.65 88.11 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.874 -1.141 . . . . 0.0 109.427 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -65.78 -42.09 91.2 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 103' ' ' MET . 13.0 tp -67.56 -51.72 47.24 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.686 -0.634 . . . . 0.0 109.871 178.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -56.12 -45.67 79.44 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.948 -1.095 . . . . 0.0 108.289 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.35 89.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.421 -0.799 . . . . 0.0 109.201 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.76 -36.63 80.87 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.527 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.9 mt -64.1 -48.72 84.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.424 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 58.1 t0 -62.22 -37.64 86.15 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.957 -1.09 . . . . 0.0 108.256 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.65 -33.27 84.43 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.641 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 28.1 p-10 -92.27 -31.63 15.33 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.9 -1.353 . . . . 0.0 110.424 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.641 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 81.8 mtm180 . . . . . 0 N--CA 1.49 1.544 0 O-C-N 120.613 -1.305 . . . . 0.0 109.418 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -114.74 89.54 3.12 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.421 -1.046 . . . . 0.0 109.338 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.13 137.35 51.57 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.381 -0.824 . . . . 0.0 109.603 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -56.94 -37.87 72.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.406 -0.809 . . . . 0.0 109.997 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.28 -43.93 96.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.996 -1.065 . . . . 0.0 108.744 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -56.96 -39.41 74.52 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.373 -0.83 . . . . 0.0 109.014 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 44' ' ' ASN . 5.9 mm100 -74.0 -34.87 64.34 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.265 -0.897 . . . . 0.0 109.271 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.18 -49.38 74.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.952 -1.092 . . . . 0.0 109.83 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.6 mtmm -60.74 -35.63 76.84 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.035 -1.041 . . . . 0.0 108.911 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -66.35 -49.99 65.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.55 -0.719 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.28 -35.86 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 120.771 -1.206 . . . . 0.0 108.901 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.572 ' NH1' ' OE2' ' A' ' 18' ' ' GLU . 0.5 OUTLIER -54.83 -40.47 69.61 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.374 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -59.76 -31.64 69.84 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.493 ' HB3' HD13 ' A' ' 29' ' ' LEU . 13.1 mt -70.77 -37.31 73.35 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.354 -0.841 . . . . 0.0 111.129 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.3 m-85 -79.25 -33.0 43.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.487 -1.383 . . . . 0.0 110.329 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.572 ' OE2' ' NH1' ' A' ' 14' ' ' ARG . 97.8 mt-10 -66.24 -30.06 70.43 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.915 -1.115 . . . . 0.0 110.45 -178.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.679 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.9 mt -36.17 -40.39 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 O-C-N 121.719 -0.613 . . . . 0.0 110.687 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -171.68 164.6 6.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.654 -1.279 . . . . 0.0 110.766 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -90.79 65.6 5.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.748 -0.595 . . . . 0.0 110.103 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.569 ' OD1' ' N ' ' A' ' 25' ' ' ARG . 10.8 t70 -112.42 95.72 32.75 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.351 -0.843 . . . . 0.0 108.847 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.46 -41.72 35.92 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.369 2.046 . . . . 0.0 112.217 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -60.06 -41.0 91.42 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.208 -0.932 . . . . 0.0 108.486 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.679 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.4 ttt180 -61.32 -38.96 88.77 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.631 -0.668 . . . . 0.0 110.134 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -59.88 -48.89 79.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.191 -0.943 . . . . 0.0 109.41 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -53.46 -38.49 63.63 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.51 -0.744 . . . . 0.0 109.367 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -64.55 -61.25 2.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.976 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD13 ' HB3' ' A' ' 16' ' ' LEU . 49.1 mt -55.47 -46.67 76.82 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.334 -0.854 . . . . 0.0 108.781 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -62.0 -49.11 77.36 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.219 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 53.3 t0 -66.7 -42.44 86.42 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -57.89 -50.37 73.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.103 -0.998 . . . . 0.0 110.192 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 46.6 m-85 -61.19 -35.21 76.54 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 118.064 -1.454 . . . . 0.0 107.54 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.529 ' HG ' ' H ' ' A' ' 35' ' ' PHE . 32.3 p -70.76 -53.62 14.78 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.716 0.77 . . . . 0.0 109.371 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.529 ' H ' ' HG ' ' A' ' 34' ' ' SER . 43.9 t80 -57.4 -44.02 84.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.701 -0.624 . . . . 0.0 110.402 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mmm -56.71 -34.46 67.48 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.365 -0.834 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.423 ' C ' ' OE1' ' A' ' 37' ' ' GLN . 5.2 tm0? -54.43 -41.68 69.65 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' NZ ' ' CD1' ' A' ' 35' ' ' PHE . 6.6 ttpm? -67.07 -40.09 86.97 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.498 -0.751 . . . . 0.0 109.578 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.403 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.8 mmm180 -64.41 -30.76 71.8 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.811 -0.556 . . . . 0.0 109.913 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.24 0.71 65.23 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.1 p -117.17 85.25 18.46 Favored Pre-proline 0 N--CA 1.488 1.44 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -83.47 145.97 12.03 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.537 2.158 . . . . 0.0 111.281 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 15.7 mt -86.9 104.81 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 120.921 -1.112 . . . . 0.0 110.475 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.606 ' O ' ' NE ' ' A' ' 45' ' ' ARG . 79.5 m-20 -85.34 -10.26 56.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.606 ' NE ' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -156.21 117.54 3.86 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.475 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 16' ' ' LEU . 3.2 mt -70.82 138.23 85.44 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 120.463 -1.398 . . . . 0.0 108.949 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -52.76 133.93 52.36 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 N-CA-C 109.391 -1.042 . . . . 0.0 109.391 176.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.555 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 5.8 mt -105.14 149.36 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.967 -1.083 . . . . 0.0 109.775 -179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.64 ' SD ' HD13 ' A' ' 54' ' ' LEU . 22.9 mtt -142.23 120.9 12.59 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.45 41.79 7.22 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 70.9 mttt 60.45 27.13 16.74 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.322 0.582 . . . . 0.0 109.597 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.425 ' O ' HG23 ' A' ' 48' ' ' ILE . 86.6 p -137.33 154.67 50.01 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 109.417 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 m -69.31 147.22 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 109.687 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 49' ' ' MET . 57.4 tp -84.36 127.89 34.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.345 -0.847 . . . . 0.0 109.539 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.588 ' CG ' HH22 ' A' ' 25' ' ' ARG . 4.6 m-20 -66.31 90.33 0.15 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.377 -0.827 . . . . 0.0 109.575 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.7 mt -55.57 -25.27 37.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.976 -1.078 . . . . 0.0 109.601 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -76.3 -54.64 6.49 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.227 -0.921 . . . . 0.0 111.636 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.31 -37.5 83.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.778 -1.201 . . . . 0.0 109.739 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 HD22 ' A' ' 98' ' ' LEU . 53.9 tp -58.8 -44.72 90.86 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.983 -1.073 . . . . 0.0 108.278 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.44 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.6 t80 -56.73 -68.06 0.25 Allowed 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.73 -0.606 . . . . 0.0 109.848 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -42.7 -39.87 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.371 -0.831 . . . . 0.0 111.415 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.416 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 6.1 mt -71.24 -44.35 65.49 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 118.144 -1.422 . . . . 0.0 107.628 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.794 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.4 t -59.16 -46.11 92.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.282 -0.886 . . . . 0.0 109.848 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.44 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -67.98 -35.83 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.711 -1.243 . . . . 0.0 108.414 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.75 -25.82 20.53 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.985 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.611 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.6 mpt_? -91.3 -2.9 57.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.564 -1.335 . . . . 0.0 109.109 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.31 20.55 56.77 Favored Glycine 0 N--CA 1.492 2.42 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.227 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.97 132.64 3.09 Favored Glycine 0 N--CA 1.5 2.914 0 O-C-N 120.503 -1.586 . . . . 0.0 111.407 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' HH2' ' A' ' 78' ' ' TRP . 9.7 tp -49.85 -38.35 34.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.645 -0.915 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.62 HG22 ' HA ' ' A' ' 122' ' ' LEU . 70.1 t -59.15 -42.79 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.912 -1.117 . . . . 0.0 110.814 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -56.34 -39.08 72.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.776 -1.203 . . . . 0.0 109.218 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 49.5 t -63.34 -43.59 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.756 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.486 ' CG2' HD21 ' A' ' 129' ' ' ASN . 83.6 mt -66.04 -57.16 11.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 O-C-N 120.834 -1.166 . . . . 0.0 110.284 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' HG12 ' A' ' 70' ' ' VAL . 13.5 m120 -57.1 -42.85 81.54 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.268 -0.895 . . . . 0.0 110.28 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -94.44 -7.31 41.82 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.924 . . . . 0.0 111.292 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.6 mttm 58.8 58.33 3.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.299 -0.876 . . . . 0.0 110.589 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.0 mt -91.81 13.82 17.23 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.779 -1.2 . . . . 0.0 108.51 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.562 ' HH2' HD11 ' A' ' 69' ' ' LEU . 84.0 m95 -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.372 -0.83 . . . . 0.0 108.777 178.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.529 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 2.8 mp0 -50.15 -40.18 45.68 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 120.618 -1.302 . . . . 0.0 108.342 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.611 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.3 mt-10 -68.51 -40.59 80.77 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.083 -1.011 . . . . 0.0 108.302 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.35 -52.15 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 67.4 mt -53.07 -53.61 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.519 -0.738 . . . . 0.0 109.354 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 86' ' ' HIS . 26.1 mmtp -72.01 -39.59 69.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.0 109.888 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.63 -31.57 22.82 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.63 -6.83 51.57 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.439 -1.036 . . . . 0.0 109.127 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 83' ' ' LYS . 41.9 m-70 65.86 41.12 3.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.776 -0.578 . . . . 0.0 109.921 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' CD2' ' SD ' ' A' ' 49' ' ' MET . 12.0 mt -73.02 147.78 88.62 Favored Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.405 -0.81 . . . . 0.0 109.339 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.417 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.9 Cg_endo -73.29 141.47 32.17 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 C-N-CA 122.353 2.035 . . . . 0.0 112.368 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.7 p -62.25 -0.78 0.6 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.833 . . . . 0.0 109.987 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.417 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.0 p -65.79 -23.51 66.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.09 -1.006 . . . . 0.0 109.934 -178.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 80.2 mt -98.3 105.96 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 120.96 -1.088 . . . . 0.0 109.224 178.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 50.6 p -76.19 -25.66 55.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 109.054 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.1 m -96.05 34.64 1.53 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.546 -0.721 . . . . 0.0 109.259 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.29 -64.43 0.95 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.68 25.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.315 -0.865 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.416 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 6.0 tp -58.88 -43.15 90.84 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.801 -1.187 . . . . 0.0 108.954 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.7 m -60.11 -40.14 88.63 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.085 -1.009 . . . . 0.0 108.426 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -70.55 -46.54 63.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.664 -0.647 . . . . 0.0 109.675 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.732 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.6 ttm180 -66.32 -52.09 50.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.905 -1.122 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.485 HG22 ' HE2' ' A' ' 104' ' ' LYS . 50.2 m -55.69 -54.09 48.53 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.133 -0.979 . . . . 0.0 110.228 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.555 ' OE1' ' CD2' ' A' ' 54' ' ' LEU . 1.0 OUTLIER -65.67 -43.68 88.57 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.975 -1.078 . . . . 0.0 112.012 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.794 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.5 t80 -55.68 -41.72 74.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.06 -1.65 . . . . 0.0 108.893 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.742 ' HG2' HD21 ' A' ' 122' ' ' LEU . 90.7 mtp -53.14 -50.72 63.96 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.514 -0.741 . . . . 0.0 110.621 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' A' ' 100' ' ' THR . 32.1 mttm -72.37 -53.95 10.82 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.031 -1.043 . . . . 0.0 112.875 -177.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.412 ' C ' HD12 ' A' ' 106' ' ' LEU . 27.9 m-85 -85.51 -52.63 5.71 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.1 mp -94.53 2.82 55.68 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.303 -1.498 . . . . 0.0 113.796 -175.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.635 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.1 t80 -62.98 -35.96 21.89 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 120.048 -1.657 . . . . 0.0 110.405 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.635 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 12.3 Cg_exo -68.53 -54.21 0.3 Allowed 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.13 1.887 . . . . 0.0 112.31 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.408 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 0.8 OUTLIER -56.97 -47.61 80.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.391 -0.818 . . . . 0.0 109.299 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 87.2 tt0 -68.89 -44.83 72.43 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.169 -0.957 . . . . 0.0 110.562 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.3 t -81.04 -45.97 15.74 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.977 -1.077 . . . . 0.0 111.244 -178.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 108' ' ' PRO . 44.1 tp10 -67.76 -51.7 45.9 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.634 -1.291 . . . . 0.0 111.518 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -73.72 -33.14 64.23 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.855 -1.153 . . . . 0.0 111.797 -178.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HG2' HD21 ' A' ' 116' ' ' LEU . 34.1 tptt -114.55 -29.48 6.82 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.833 -1.167 . . . . 0.0 111.784 -177.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 111' ' ' CYS . 53.5 t30 57.29 44.79 21.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.6 -1.313 . . . . 0.0 110.288 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.444 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.8 mt -66.08 -30.06 70.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.223 -0.923 . . . . 0.0 110.581 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -154.47 -167.25 2.56 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.917 -178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' A' ' 117' ' ' SER . 82.1 p -129.01 159.49 68.47 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.515 -0.741 . . . . 0.0 109.672 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -55.52 -40.29 86.3 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.595 1.53 . . . . 0.0 112.207 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.29 -37.59 87.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.015 -1.053 . . . . 0.0 109.379 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.424 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.28 -46.06 74.75 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 103' ' ' MET . 17.6 tp -65.61 -53.28 43.85 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.404 -0.81 . . . . 0.0 109.942 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -56.86 -44.49 82.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.054 . . . . 0.0 108.907 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.05 85.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.114 -0.991 . . . . 0.0 109.155 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.439 ' CB ' HD21 ' A' ' 74' ' ' ASN . . . -68.28 -35.97 78.67 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.742 HD11 ' SD ' ' A' ' 103' ' ' MET . 29.4 mt -64.09 -49.82 79.72 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.14 -38.46 86.48 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.88 88.67 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.732 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 12.9 p30 -94.05 -31.68 14.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.073 -1.251 . . . . 0.0 110.078 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.518 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 55.2 mtp180 -63.91 145.48 55.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.853 -1.154 . . . . 0.0 109.607 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.572 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -63.83 140.1 58.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.389 -0.82 . . . . 0.0 109.292 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -66.52 -19.95 65.91 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.162 -0.961 . . . . 0.0 109.444 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.724 0 O4'-C1'-C2' 108.31 2.009 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.262 0 O4'-C4'-C3' 107.853 2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.871 0 O4'-C4'-C3' 107.625 2.025 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.119 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.917 0 O5'-C5'-C4' 113.052 2.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.796 0 O5'-C5'-C4' 112.976 1.983 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.636 0 O5'-C5'-C4' 113.221 2.158 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.555 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.143 0 O4'-C4'-C3' 107.754 2.154 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.906 0 O5'-C5'-C4' 113.283 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.413 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.248 0 O4'-C1'-C2' 108.566 2.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.413 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.85 0 O5'-C5'-C4' 113.205 2.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.078 0 O5'-C5'-C4' 113.439 2.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.055 0 O4'-C4'-C3' 107.797 2.197 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.777 0 O4'-C4'-C3' 107.561 1.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O4'-C4'-C3' 108.004 2.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.823 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.939 0 O4'-C1'-C2' 109.038 2.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.362 0 C4'-C3'-C2' 105.696 2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.493 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 1.972 0 O5'-C5'-C4' 112.8 1.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.493 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.542 0 O5'-C5'-C4' 113.653 2.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.5 ' OP1' ' NH1' ' A' ' 99' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -1.844 0 O4'-C4'-C3' 107.958 2.358 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.416 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O4'-C4'-C3' 107.782 2.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O5'-C5'-C4' 113.468 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.802 0 O5'-C5'-C4' 113.671 2.48 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C1'-C2' 108.839 2.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.234 0 O4'-C4'-C3' 108.035 2.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.322 0 O4'-C4'-C3' 107.585 1.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.498 0 O4'-C4'-C3' 107.729 2.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.894 0 O5'-C5'-C4' 112.933 1.952 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C4'-C3' 107.751 2.151 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.162 0 C1'-O4'-C4' 106.174 -2.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.594 ' CZ2' ' ND2' ' A' ' 44' ' ' ASN . 32.0 p90 -96.38 108.78 21.36 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.369 -1.077 . . . . 0.0 109.524 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.2 p -62.62 158.93 17.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.173 -0.955 . . . . 0.0 110.109 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -58.61 -28.9 66.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.614 -0.678 . . . . 0.0 109.873 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.61 -47.98 82.97 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.05 -1.031 . . . . 0.0 109.074 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -49.79 -40.45 41.64 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.3 mp0 -74.25 -36.79 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.482 -0.761 . . . . 0.0 109.009 178.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -48.51 -52.58 21.77 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.882 . . . . 0.0 109.81 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -61.22 -39.92 92.07 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.2 -0.938 . . . . 0.0 108.9 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.414 ' C ' HD11 ' A' ' 46' ' ' LEU . 14.3 mm100 -66.52 -49.18 67.38 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.365 -0.834 . . . . 0.0 110.798 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -70.96 -37.79 69.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 120.497 -1.377 . . . . 0.0 108.789 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -53.3 -39.21 63.83 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.592 -1.317 . . . . 0.0 107.761 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.8 mm-40 -58.93 -31.47 68.71 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.458 ' CD1' HD22 ' A' ' 46' ' ' LEU . 8.3 mt -72.48 -38.75 68.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.281 -0.887 . . . . 0.0 111.504 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -76.49 -33.24 58.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.433 -1.417 . . . . 0.0 110.314 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.479 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.5 mm-40 -66.98 -26.63 66.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.967 -1.083 . . . . 0.0 110.55 -178.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.697 HG21 HH12 ' A' ' 25' ' ' ARG . 32.2 mt -37.56 -38.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 O-C-N 121.798 -0.564 . . . . 0.0 110.487 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -170.72 161.62 7.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.858 -1.151 . . . . 0.0 110.323 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.7 p30 -88.99 66.52 7.88 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.539 0.685 . . . . 0.0 109.342 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -112.04 93.56 21.93 Favored Pre-proline 0 N--CA 1.489 1.503 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -47.1 -37.98 23.92 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.238 1.958 . . . . 0.0 112.004 -178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -62.77 -40.17 96.47 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.241 -0.912 . . . . 0.0 108.829 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.697 HH12 HG21 ' A' ' 19' ' ' ILE . 62.6 ttt180 -61.35 -37.08 82.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.478 -0.763 . . . . 0.0 110.454 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -60.16 -50.71 72.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.131 -0.981 . . . . 0.0 109.428 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -53.25 -38.77 63.32 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.431 -0.793 . . . . 0.0 109.677 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -62.01 -62.91 1.45 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.369 -0.832 . . . . 0.0 110.803 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 49.9 mt -55.57 -44.16 76.61 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.448 -0.782 . . . . 0.0 109.414 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.99 -48.57 81.22 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.68 -42.73 86.04 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.132 -0.98 . . . . 0.0 109.546 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.48 -53.19 60.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.29 -0.881 . . . . 0.0 110.333 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -62.3 -33.25 74.31 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 118.483 -1.287 . . . . 0.0 107.811 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -67.92 -56.59 8.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.617 -0.677 . . . . 0.0 109.663 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 49.4 t80 -60.78 -42.28 97.22 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.253 -0.904 . . . . 0.0 110.3 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.483 ' CE ' ' O ' ' A' ' 41' ' ' THR . 73.7 mmm -59.17 -40.54 85.92 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.534 -0.729 . . . . 0.0 110.912 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -60.44 -41.57 94.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.954 -1.092 . . . . 0.0 109.72 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -61.9 -47.44 84.95 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.576 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.458 HH11 ' HB3' ' A' ' 108' ' ' PRO . 13.2 mtp180 -64.38 -20.93 66.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.105 -0.997 . . . . 0.0 111.282 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.35 3.01 58.82 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.723 -1.751 . . . . 0.0 108.723 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.483 ' O ' ' CE ' ' A' ' 36' ' ' MET . 34.3 p -117.6 83.67 17.82 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.46 -1.024 . . . . 0.0 108.874 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -91.57 139.84 2.39 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 123.054 2.503 . . . . 0.0 112.146 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 78.3 mt -73.46 99.0 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.02 -1.05 . . . . 0.0 109.026 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 94.2 m-20 -64.82 -45.48 86.02 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -133.99 132.58 40.29 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' CD1' ' A' ' 16' ' ' LEU . 2.0 mt -70.97 142.66 88.02 Favored Pre-proline 0 C--N 1.299 -1.607 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.702 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -66.69 134.02 33.76 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.221 1.281 . . . . 0.0 109.095 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.5 mt -100.15 145.71 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.884 -1.135 . . . . 0.0 110.068 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.719 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.7 mtp -141.56 118.84 11.42 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.43 43.13 1.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm 57.35 22.48 7.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.752 -0.593 . . . . 0.0 109.649 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.1 m -136.4 152.93 51.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 109.416 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.3 m -68.03 147.69 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 109.11 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.719 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.1 tp -79.45 123.17 27.28 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.412 -0.805 . . . . 0.0 110.369 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.529 ' CG ' HH22 ' A' ' 25' ' ' ARG . 12.1 m-20 -63.05 92.38 0.05 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.52 -0.738 . . . . 0.0 109.495 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.53 -27.57 57.83 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.989 -1.069 . . . . 0.0 109.718 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -78.21 -59.97 2.56 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.067 -1.021 . . . . 0.0 111.615 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -58.59 -36.33 73.83 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.743 -1.223 . . . . 0.0 109.871 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.549 HD22 HD21 ' A' ' 54' ' ' LEU . 28.7 tp -62.93 -42.86 99.94 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.442 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.2 t80 -62.83 -68.08 0.37 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 60' ' ' TYR . 61.8 t30 -42.78 -34.67 0.97 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.469 -0.769 . . . . 0.0 109.35 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.883 HD22 HH22 ' A' ' 66' ' ' ARG . 13.6 mt -71.66 -50.89 26.33 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.844 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.6 t -56.6 -43.14 77.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.494 -0.754 . . . . 0.0 110.067 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.442 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.6 mm -69.68 -34.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.69 -1.256 . . . . 0.0 108.027 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.409 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.51 -20.11 29.21 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.146 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.883 HH22 HD22 ' A' ' 62' ' ' LEU . 15.6 mmt-85 -95.13 -1.34 52.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.644 -1.285 . . . . 0.0 108.438 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.85 16.46 72.66 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.238 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 140.98 130.31 2.59 Favored Glycine 0 N--CA 1.502 3.049 0 CA-C-N 119.569 1.685 . . . . 0.0 111.618 178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.646 HD11 ' CH2' ' A' ' 78' ' ' TRP . 13.1 tp -50.95 -41.83 59.34 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.631 -0.923 . . . . 0.0 110.465 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.0 t -57.86 -43.05 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.952 -1.092 . . . . 0.0 109.25 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -55.95 -37.5 69.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.111 -0.993 . . . . 0.0 108.656 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.1 t -66.73 -43.99 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.632 -0.667 . . . . 0.0 109.975 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.15 -57.58 9.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.759 -1.213 . . . . 0.0 110.124 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.518 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 70.7 m-20 -58.02 -42.08 84.52 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.246 -0.909 . . . . 0.0 110.354 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.61 -9.02 39.44 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.279 -0.888 . . . . 0.0 110.692 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.626 ' N ' ' O ' ' A' ' 72' ' ' VAL . 25.1 mtmt 58.46 57.62 3.76 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.462 -0.773 . . . . 0.0 110.265 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.9 mt -91.37 12.63 19.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.951 -1.093 . . . . 0.0 108.594 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.646 ' CH2' HD11 ' A' ' 69' ' ' LEU . 87.6 m95 -61.11 -40.81 95.18 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt-30 -48.44 -40.93 27.9 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.898 -1.126 . . . . 0.0 108.749 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.708 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -66.61 -38.9 87.94 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.424 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.1 mt -72.9 -52.71 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.645 HD11 ' HB2' ' A' ' 95' ' ' ALA . 63.7 mt -54.15 -56.19 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.578 -0.701 . . . . 0.0 109.491 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 86' ' ' HIS . 44.9 mttp -66.68 -41.14 88.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.095 -1.003 . . . . 0.0 109.631 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.82 -30.67 29.58 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 mt -90.47 -8.78 49.59 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.428 -1.042 . . . . 0.0 109.099 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 83' ' ' LYS . 21.8 m80 63.78 42.41 6.19 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.591 -0.693 . . . . 0.0 109.868 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.72 139.41 80.52 Favored Pre-proline 0 C--N 1.304 -1.405 0 O-C-N 121.242 -0.911 . . . . 0.0 108.583 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 40.0 Cg_endo -69.93 142.95 48.56 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 121.915 1.743 . . . . 0.0 112.213 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.9 t -55.94 0.61 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.259 -0.901 . . . . 0.0 109.814 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 93.2 p -66.84 -26.0 66.7 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.222 -0.924 . . . . 0.0 110.193 -178.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.541 HD11 ' H ' ' A' ' 50' ' ' ALA . 87.4 mt -101.47 107.41 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 120.92 -1.112 . . . . 0.0 109.522 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.9 p -79.05 -25.32 43.17 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.251 -0.905 . . . . 0.0 109.027 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -95.33 35.02 1.35 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.561 -0.712 . . . . 0.0 109.445 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.61 -65.2 0.73 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.138 -0.976 . . . . 0.0 108.631 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.645 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.17 -52.98 18.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.302 -0.874 . . . . 0.0 109.21 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.463 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 9.0 tp -58.95 -43.97 91.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.992 -1.067 . . . . 0.0 109.182 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 m -61.71 -39.96 93.36 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.953 -1.092 . . . . 0.0 108.692 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.503 HD22 HD13 ' A' ' 59' ' ' LEU . 12.0 mt -67.77 -44.22 77.96 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.562 -0.711 . . . . 0.0 110.068 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.814 ' NH1' HD21 ' A' ' 129' ' ' ASN . 28.6 ttm180 -68.81 -49.96 54.18 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.287 -0.883 . . . . 0.0 111.178 -179.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -52.94 -53.18 53.27 Favored 'General case' 0 C--N 1.294 -1.837 0 C-N-CA 118.717 -1.193 . . . . 0.0 109.115 -178.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -63.83 -42.41 97.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.153 -0.967 . . . . 0.0 111.745 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.844 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.4 t80 -58.96 -43.91 91.38 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.207 -1.558 . . . . 0.0 109.395 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.75 ' HG2' HD21 ' A' ' 122' ' ' LEU . 89.7 mtp -51.52 -56.84 11.16 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.505 -0.747 . . . . 0.0 111.372 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -72.78 -52.67 14.06 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.767 -1.208 . . . . 0.0 112.701 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -85.14 -50.37 7.47 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -174.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.58 -5.02 40.13 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.126 -1.609 . . . . 0.0 114.109 -175.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.9 t80 -60.12 -38.56 60.51 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 119.687 -1.883 . . . . 0.0 109.62 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.7 Cg_exo -65.64 -54.79 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.421 2.081 . . . . 0.0 112.6 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.78 -39.55 81.4 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.367 -0.833 . . . . 0.0 109.137 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.401 ' OE1' ' N ' ' A' ' 111' ' ' CYS . 0.4 OUTLIER -73.12 -51.16 18.99 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.455 -0.778 . . . . 0.0 110.287 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -71.42 -43.02 67.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.403 -0.81 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.93 -51.09 59.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.863 -1.148 . . . . 0.0 111.033 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -74.71 -27.88 60.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.146 -0.971 . . . . 0.0 111.691 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG2' HD21 ' A' ' 116' ' ' LEU . 30.7 tptt -123.26 -30.31 3.72 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.911 -1.118 . . . . 0.0 111.298 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 111' ' ' CYS . 40.0 t30 57.41 45.95 19.01 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.819 -1.176 . . . . 0.0 110.12 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 114' ' ' LYS . 60.1 mt -67.03 -31.72 72.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.174 -0.954 . . . . 0.0 110.894 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.2 t -154.39 -166.97 2.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.94 -1.1 . . . . 0.0 111.316 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.508 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.0 p -127.79 158.46 70.27 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.646 -0.659 . . . . 0.0 109.98 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -55.87 -41.32 78.43 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 121.651 1.567 . . . . 0.0 112.256 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.31 90.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.849 -1.157 . . . . 0.0 109.668 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.07 -42.4 89.47 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 103' ' ' MET . 27.9 tp -68.49 -52.71 29.31 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.71 -0.619 . . . . 0.0 110.173 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -58.26 -46.41 86.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.382 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.48 -42.23 98.47 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -0.854 . . . . 0.0 110.162 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.518 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -67.72 -33.62 75.24 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.599 HD11 ' SD ' ' A' ' 103' ' ' MET . 11.1 mt -65.9 -46.49 88.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.409 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 61.7 t0 -64.73 -37.76 88.68 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.982 -1.074 . . . . 0.0 109.391 179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.37 -29.86 75.61 Favored Glycine 0 N--CA 1.492 2.397 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.033 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.814 HD21 ' NH1' ' A' ' 99' ' ' ARG . 33.9 p-10 -92.0 -31.43 15.6 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.863 -1.374 . . . . 0.0 111.424 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.651 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 76.3 mtm180 -62.51 146.74 50.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.516 -1.365 . . . . 0.0 110.237 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.617 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -62.59 147.58 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.617 -0.677 . . . . 0.0 109.672 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -64.8 -17.76 64.5 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.201 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.854 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.434 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.846 0 O4'-C1'-C2' 108.0 1.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.51 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.126 0 O4'-C1'-C2' 108.585 2.259 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.991 0 O4'-C4'-C3' 107.483 1.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.336 0 O5'-C5'-C4' 113.368 2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O5'-C5'-C4' 112.884 1.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.523 0 O5'-C5'-C4' 113.254 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.052 0 O5'-C5'-C4' 113.115 2.082 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.534 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.26 0 O4'-C1'-C2' 108.453 2.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.071 0 O5'-C5'-C4' 113.147 2.105 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.41 0 O4'-C1'-C2' 108.583 2.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.77 0 O4'-C4'-C3' 107.648 2.048 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.876 0 O4'-C4'-C3' 107.946 2.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.89 0 O4'-C4'-C3' 107.849 2.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 O4'-C4'-C3' 107.501 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.159 0 O4'-C4'-C3' 107.999 2.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.461 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.42 -2.333 0 O4'-C1'-C2' 107.717 1.47 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.461 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O4'-C4'-C3' 107.895 2.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O5'-C5'-C4' 112.519 1.656 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.57 0 O5'-C5'-C4' 113.739 2.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.633 0 O4'-C4'-C3' 107.934 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.6 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.779 0 O5'-C5'-C4' 112.834 1.882 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.6 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.021 0 O5'-C5'-C4' 113.638 2.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.996 0 O5'-C5'-C4' 113.54 2.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.929 0 O4'-C1'-C2' 108.858 2.508 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.25 0 O4'-C4'-C3' 108.053 2.453 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O4'-C4'-C3' 107.658 2.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.47 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.766 0 O4'-C4'-C3' 107.633 2.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O5'-C5'-C4' 112.996 1.997 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.056 0 O4'-C4'-C3' 107.501 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -114.21 84.56 2.07 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.367 -1.078 . . . . 0.0 109.238 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -112.04 139.65 47.38 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.383 -0.823 . . . . 0.0 109.261 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -54.96 -37.22 66.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -0.902 . . . . 0.0 109.946 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.02 -42.2 98.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.966 -1.084 . . . . 0.0 109.504 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -58.33 -34.31 70.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.395 -0.815 . . . . 0.0 109.829 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.771 ' O ' HG12 ' A' ' 13' ' ' VAL . 36.0 mm-40 -70.6 -54.28 12.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.228 -0.92 . . . . 0.0 110.849 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -49.2 -46.67 45.96 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.724 -1.235 . . . . 0.0 109.252 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -61.18 -40.73 95.01 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.43 -0.794 . . . . 0.0 109.532 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.49 -53.17 25.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.323 -0.861 . . . . 0.0 111.404 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -68.87 -36.14 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 120.803 -1.186 . . . . 0.0 109.279 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -58.74 -38.44 78.39 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.301 -1.499 . . . . 0.0 108.03 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -59.41 -31.71 69.51 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.218 -0.926 . . . . 0.0 108.655 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.494 ' HB3' HD13 ' A' ' 29' ' ' LEU . 7.0 mt -67.09 -40.37 86.96 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.31 -0.869 . . . . 0.0 111.166 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 83.3 m-85 -74.9 -35.59 62.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.487 -1.383 . . . . 0.0 109.595 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.483 ' O ' ' C ' ' A' ' 19' ' ' ILE . 99.1 mt-10 -64.43 -29.9 70.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.627 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.508 HD13 ' NH2' ' A' ' 25' ' ' ARG . 24.2 mt -37.4 -41.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.607 -0.683 . . . . 0.0 110.702 -178.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -171.56 163.33 6.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.716 -1.24 . . . . 0.0 110.891 -178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -90.3 69.91 7.08 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.462 0.649 . . . . 0.0 109.596 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.01 94.93 27.24 Favored Pre-proline 0 N--CA 1.489 1.523 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -46.69 -44.44 21.7 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 122.166 1.911 . . . . 0.0 112.024 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -63.43 -40.37 96.97 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.179 -0.95 . . . . 0.0 108.615 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.508 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.3 ttt180 -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.433 -0.792 . . . . 0.0 109.803 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.0 -49.04 79.24 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.16 -0.963 . . . . 0.0 108.686 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -53.61 -38.25 63.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.463 -0.773 . . . . 0.0 109.385 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -64.03 -59.84 3.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.465 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 16' ' ' LEU . 28.4 mt -56.45 -45.54 80.77 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.124 -0.985 . . . . 0.0 108.657 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.457 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 40.8 m-20 -60.15 -47.95 83.79 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.567 -0.853 . . . . 0.0 108.843 179.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -66.41 -43.49 85.6 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.484 -0.76 . . . . 0.0 109.889 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 tp -58.64 -49.75 76.37 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.211 -0.931 . . . . 0.0 110.306 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.6 ' CE1' HD12 ' A' ' 43' ' ' ILE . 49.4 m-85 -59.92 -36.93 78.07 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.953 -1.499 . . . . 0.0 107.792 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.4 m -69.71 -49.86 49.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.363 -0.836 . . . . 0.0 109.813 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.411 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 72.9 t80 -59.12 -46.21 88.92 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.302 -0.874 . . . . 0.0 111.123 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.401 ' SD ' HD11 ' A' ' 43' ' ' ILE . 95.4 mtp -57.36 -34.76 69.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.75 -178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -55.6 -34.99 65.35 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.647 -1.283 . . . . 0.0 108.784 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -74.75 -34.71 62.57 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 25.3 mmm180 -66.25 -30.97 71.51 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.028 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.23 0.17 63.5 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.0 p -115.25 85.18 12.39 Favored Pre-proline 0 N--CA 1.486 1.35 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.94 140.56 14.42 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 121.94 1.76 . . . . 0.0 110.513 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.6 HD12 ' CE1' ' A' ' 33' ' ' PHE . 29.8 mt -70.47 92.03 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 120.936 -1.103 . . . . 0.0 110.591 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 88.1 m-20 -58.9 -30.1 67.54 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -167.17 140.08 3.49 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.573 HD23 HG21 ' A' ' 43' ' ' ILE . 17.1 mt -70.69 144.13 90.65 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.857 -1.152 . . . . 0.0 110.237 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.41 134.22 18.6 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.516 1.477 . . . . 0.0 108.369 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.6 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 56.6 mt -103.18 142.51 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 110.842 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.568 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.2 mtp -136.24 123.95 22.44 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.04 39.97 4.2 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt 57.57 22.39 8.12 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.273 0.558 . . . . 0.0 110.119 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.45 ' N ' HG23 ' A' ' 48' ' ' ILE . 49.3 m -134.38 151.16 51.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.257 -0.902 . . . . 0.0 109.22 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.56 143.46 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 120.774 -1.204 . . . . 0.0 108.708 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 HD22 ' A' ' 59' ' ' LEU . 64.3 tp -74.58 123.02 24.04 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.258 -0.901 . . . . 0.0 109.468 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -56.41 105.28 0.19 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.72 -30.57 71.58 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -80.21 -64.96 1.07 Allowed 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.238 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -52.95 -39.82 63.2 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 120.623 -1.298 . . . . 0.0 108.755 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.546 HD22 HD21 ' A' ' 54' ' ' LEU . 24.1 tp -55.8 -48.7 74.92 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.2 t80 -62.75 -66.8 0.49 Allowed 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.442 0.639 . . . . 0.0 109.913 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -43.06 -40.51 3.16 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.459 -0.776 . . . . 0.0 110.905 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.432 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -72.66 -47.07 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 117.897 -1.521 . . . . 0.0 107.836 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.785 HG21 ' CE2' ' A' ' 102' ' ' TYR . 26.6 t -55.34 -42.65 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.954 . . . . 0.0 109.987 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.409 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.0 mm -68.41 -35.67 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 120.504 -1.372 . . . . 0.0 107.715 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.85 -17.39 23.42 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.961 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.673 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.9 mmt-85 -96.99 5.3 50.7 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.524 -1.36 . . . . 0.0 108.986 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.6 11.24 82.14 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.646 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.99 134.56 3.29 Favored Glycine 0 N--CA 1.5 2.95 0 CA-C-N 119.252 1.526 . . . . 0.0 111.413 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 tp -48.55 -42.67 34.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.708 -0.877 . . . . 0.0 110.832 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.507 HG22 ' HA ' ' A' ' 122' ' ' LEU . 95.1 t -58.11 -40.64 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.0 110.005 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -58.59 -40.36 82.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.002 . . . . 0.0 110.034 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.581 ' O ' ' N ' ' A' ' 76' ' ' LYS . 40.3 t -64.55 -47.01 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.264 -0.897 . . . . 0.0 110.639 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.08 -56.68 16.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.814 -1.179 . . . . 0.0 109.894 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.653 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 86.7 m-20 -59.56 -43.69 93.49 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.284 -0.885 . . . . 0.0 111.568 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -94.05 -4.46 49.41 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.909 -1.119 . . . . 0.0 110.685 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.581 ' N ' ' O ' ' A' ' 72' ' ' VAL . 51.0 mttm 59.24 56.74 3.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.595 -0.691 . . . . 0.0 111.135 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.6 mt -90.51 13.84 14.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.561 -1.256 . . . . 0.0 107.941 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' ILE . 96.9 m95 -63.49 -41.41 98.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.43 ' C ' ' O ' ' A' ' 78' ' ' TRP . 22.8 mt-30 -47.86 -39.92 19.98 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 120.809 -1.182 . . . . 0.0 108.011 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.673 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.3 mt-10 -67.33 -38.54 85.07 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.463 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.0 mt -74.78 -51.91 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.37 -0.831 . . . . 0.0 108.987 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.654 HD11 ' HB2' ' A' ' 95' ' ' ALA . 60.8 mt -50.58 -51.47 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -74.65 -37.4 62.76 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.592 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.44 -32.92 46.18 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 83.2 mt -91.17 -7.31 51.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.38 -1.071 . . . . 0.0 109.255 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 28.0 m80 65.03 40.59 5.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.777 -0.577 . . . . 0.0 110.106 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.3 mt -72.5 136.83 80.82 Favored Pre-proline 0 N--CA 1.488 1.467 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 35.7 Cg_endo -68.54 144.23 60.06 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.891 1.727 . . . . 0.0 112.48 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.0 p -58.19 0.66 0.06 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.265 -0.897 . . . . 0.0 109.654 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 18.0 m -64.07 -35.31 80.32 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.138 -0.976 . . . . 0.0 109.301 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.594 HD11 ' H ' ' A' ' 50' ' ' ALA . 89.5 mt -90.07 97.41 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.939 -1.101 . . . . 0.0 108.54 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 68.7 p -66.62 -27.86 68.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.873 . . . . 0.0 109.813 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.8 m -102.46 47.77 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.169 -0.957 . . . . 0.0 109.512 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.71 -59.43 3.58 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.169 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.654 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.83 -51.14 23.91 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.287 -0.883 . . . . 0.0 109.879 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.474 HD12 HH21 ' A' ' 99' ' ' ARG . 5.6 tp -58.4 -44.29 88.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.748 -1.22 . . . . 0.0 109.039 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.3 m -60.81 -40.46 92.78 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.152 -0.968 . . . . 0.0 108.694 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.433 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 10.5 mt -71.18 -44.28 65.76 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.483 -0.761 . . . . 0.0 109.941 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.798 HH12 HD21 ' A' ' 129' ' ' ASN . 40.9 ttp180 -66.5 -53.1 38.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.24 -0.912 . . . . 0.0 110.947 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -56.59 -52.28 65.42 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.473 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -62.46 -40.08 95.46 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.046 -1.034 . . . . 0.0 110.978 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.785 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.7 t80 -57.08 -41.0 78.02 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.382 -1.449 . . . . 0.0 109.2 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.571 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -54.65 -54.72 37.89 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.463 -0.773 . . . . 0.0 111.396 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.8 mttt -72.65 -50.54 24.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.564 -1.335 . . . . 0.0 113.098 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.463 ' C ' HD12 ' A' ' 106' ' ' LEU . 34.3 m-85 -84.8 -52.86 5.74 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -174.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.0 mp -100.44 12.65 36.76 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.222 -1.549 . . . . 0.0 114.391 -175.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.525 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 62.7 t80 -67.37 -38.65 16.6 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 119.796 -1.815 . . . . 0.0 111.815 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.1 Cg_endo -78.05 -40.09 0.41 Allowed 'Trans proline' 0 N--CA 1.49 1.302 0 C-N-CA 121.475 1.45 . . . . 0.0 112.834 -178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.14 -42.97 87.04 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -68.96 -51.89 34.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.634 -0.666 . . . . 0.0 110.256 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.526 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.7 m -71.45 -43.69 66.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.376 -0.827 . . . . 0.0 110.932 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 46.4 tp10 -66.72 -50.26 63.38 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.086 -1.009 . . . . 0.0 111.223 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -75.83 -26.54 57.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.021 -1.049 . . . . 0.0 111.402 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.431 ' HG2' HD21 ' A' ' 116' ' ' LEU . 29.1 tptt -125.33 -30.46 3.14 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.043 -1.036 . . . . 0.0 111.82 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 111' ' ' CYS . 28.9 t-20 59.66 45.11 13.46 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.737 -1.227 . . . . 0.0 110.206 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.431 HD21 ' HG2' ' A' ' 114' ' ' LYS . 84.6 mt -69.57 -32.15 70.76 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.136 -0.978 . . . . 0.0 111.288 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 118' ' ' THR . 32.0 t -153.12 -167.04 2.6 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.515 -1.274 . . . . 0.0 112.064 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.531 ' N ' ' OG ' ' A' ' 117' ' ' SER . 40.1 p -129.81 155.26 80.75 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 121.835 -0.541 . . . . 0.0 109.695 -178.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.01 -40.63 80.4 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.112 1.875 . . . . 0.0 112.122 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.79 88.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.821 -1.174 . . . . 0.0 109.254 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.67 -45.25 79.53 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.571 HD21 ' HG3' ' A' ' 103' ' ' MET . 34.6 tp -65.97 -51.77 55.5 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -57.26 -47.34 81.67 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.234 -0.916 . . . . 0.0 109.533 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.84 90.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.402 -0.811 . . . . 0.0 109.873 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.653 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.46 -36.09 78.51 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.055 0.931 . . . . 0.0 108.547 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.427 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 34.1 mt -65.59 -48.33 83.05 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.031 0 CA-C-O 121.521 0.677 . . . . 0.0 109.191 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -64.19 -37.22 86.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.406 -0.809 . . . . 0.0 109.095 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.6 -36.01 92.62 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.798 HD21 HH12 ' A' ' 99' ' ' ARG . 0.1 OUTLIER -93.87 -36.0 12.43 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.115 -1.226 . . . . 0.0 110.63 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.662 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 57.4 mtp180 -66.75 148.93 51.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.677 -1.264 . . . . 0.0 109.778 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.63 171.34 0.32 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.283 -0.886 . . . . 0.0 108.982 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -110.74 -156.59 0.59 Allowed 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.464 -0.772 . . . . 0.0 109.019 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 179.99 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.405 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O4'-C1'-C2' 108.244 1.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.597 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.906 0 O4'-C1'-C2' 108.805 2.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.108 0 O4'-C4'-C3' 107.38 1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.233 0 O5'-C5'-C4' 113.317 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O5'-C5'-C4' 113.008 2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.962 0 O5'-C5'-C4' 113.219 2.156 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.875 0 O5'-C5'-C4' 112.851 1.893 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.6 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.522 1.406 0 O4'-C1'-C2' 108.404 2.095 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . 0.533 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.337 0 O5'-C5'-C4' 113.209 2.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.292 0 O4'-C4'-C3' 107.842 2.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O5'-C5'-C4' 113.154 2.11 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . 0.429 ' N2 ' ' C2 ' ' C' ' 420' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.405 0 O5'-C5'-C4' 113.45 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . 0.412 ' H71' " C2'" ' B' ' 412' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.16 0 O4'-C4'-C3' 107.994 2.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.921 0 O4'-C4'-C3' 107.663 2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.162 0 O4'-C4'-C3' 108.026 2.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.806 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C1'-C2' 109.051 2.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.59 0 O4'-C1'-C2' 108.811 2.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.371 0 O5'-C5'-C4' 112.698 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.47 H5'' ' HZ2' ' A' ' 76' ' ' LYS . . . . . . . . 0 P--O5' 1.609 1.557 0 O5'-C5'-C4' 113.892 2.637 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.515 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 P--O5' 1.61 1.713 0 O5'-C5'-C4' 113.335 2.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.533 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.033 0 O5'-C5'-C4' 113.054 2.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.533 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O5'-C5'-C4' 113.625 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.902 0 O5'-C5'-C4' 113.377 2.269 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.298 0 O4'-C1'-C2' 108.772 2.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.018 0 O4'-C4'-C3' 107.868 2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.424 0 O4'-C4'-C3' 107.394 1.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.758 0 O4'-C4'-C3' 107.84 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.882 0 O4'-C4'-C3' 107.605 2.005 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 113.101 2.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.782 0 O4'-C4'-C3' 107.595 1.995 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -111.61 87.24 2.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.364 -1.08 . . . . 0.0 109.47 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.82 138.15 51.1 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.307 -0.871 . . . . 0.0 109.833 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -56.74 -37.58 71.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.553 -0.717 . . . . 0.0 110.48 -178.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.38 -42.85 95.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.838 -1.164 . . . . 0.0 109.267 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -54.83 -45.38 74.44 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.238 -0.914 . . . . 0.0 109.138 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -67.28 -37.38 83.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 108.95 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -53.55 -48.52 69.03 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.308 -0.87 . . . . 0.0 109.471 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -62.45 -38.97 91.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.101 -0.999 . . . . 0.0 109.204 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.31 -48.74 72.04 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.77 . . . . 0.0 110.386 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -74.06 -34.67 39.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 O-C-N 120.761 -1.212 . . . . 0.0 108.218 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -54.65 -40.6 69.18 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.49 -31.08 69.03 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.7 mt -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.829 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.7 m-85 -81.54 -32.24 32.36 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.536 -1.352 . . . . 0.0 110.458 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.6 mt-10 -67.73 -31.02 70.67 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.827 -1.171 . . . . 0.0 110.432 -178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 16' ' ' LEU . 14.6 mt -35.28 -39.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.784 -0.572 . . . . 0.0 110.556 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.573 ' ND2' ' OD1' ' A' ' 22' ' ' ASP . 41.3 p-10 -173.72 167.06 4.5 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.97 -1.081 . . . . 0.0 110.034 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -94.22 64.75 3.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.624 -0.673 . . . . 0.0 109.821 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.573 ' OD1' ' ND2' ' A' ' 20' ' ' ASN . 1.7 m-20 -96.33 141.4 23.06 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.061 -1.024 . . . . 0.0 108.811 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.48 -61.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.14 1.893 . . . . 0.0 112.329 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -60.81 -34.09 74.01 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.858 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.718 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -55.53 -44.95 77.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.98 -1.075 . . . . 0.0 109.954 -179.109 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -61.89 -54.71 38.28 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.04 -1.037 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.05 -37.91 61.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 108.872 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -61.37 -62.81 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.396 -0.815 . . . . 0.0 109.392 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.503 HD11 ' NH1' ' A' ' 25' ' ' ARG . 69.2 mt -54.17 -47.74 71.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.538 -0.726 . . . . 0.0 109.684 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.31 -49.26 77.72 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.197 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -66.63 -42.3 86.99 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.998 -1.064 . . . . 0.0 109.635 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.67 -52.53 65.06 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.271 -0.893 . . . . 0.0 110.356 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -60.54 -34.34 73.99 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.984 -1.486 . . . . 0.0 107.74 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.3 m -69.29 -53.43 19.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.372 -0.83 . . . . 0.0 109.51 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.409 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 72.2 t80 -59.51 -40.13 86.07 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.568 -0.707 . . . . 0.0 110.57 -179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 75.3 mmm -58.96 -37.8 77.61 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.333 -0.854 . . . . 0.0 110.83 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.93 -39.41 94.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.909 -1.119 . . . . 0.0 110.286 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -69.47 -30.58 68.5 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.91 -1.119 . . . . 0.0 108.358 179.417 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.431 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -67.27 -30.58 70.49 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.76 -2.21 58.47 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 107.389 -2.284 . . . . 0.0 107.389 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 75.2 p -118.86 84.41 25.6 Favored Pre-proline 0 N--CA 1.491 1.597 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -83.02 137.15 8.4 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.561 2.174 . . . . 0.0 111.082 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.9 mt -73.98 97.73 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.038 -1.038 . . . . 0.0 109.94 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.41 -43.68 89.81 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.578 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.33 133.4 38.78 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.422 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.4 mt -70.33 146.64 94.6 Favored Pre-proline 0 C--N 1.298 -1.65 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.528 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -67.08 127.29 16.54 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 121.209 1.273 . . . . 0.0 109.186 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.569 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.0 mt -96.11 143.67 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.848 -1.158 . . . . 0.0 109.763 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.841 ' SD ' HG21 ' A' ' 97' ' ' THR . 57.3 mmm -140.54 123.35 16.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.669 0.747 . . . . 0.0 108.991 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.4 41.42 3.27 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.1 mttt 57.93 23.32 9.7 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.45 0.643 . . . . 0.0 109.89 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 89.7 p -136.98 155.62 49.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 108.936 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.28 148.42 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.972 -1.08 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HG3' ' A' ' 49' ' ' MET . 34.5 tp -81.66 122.91 28.22 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.685 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -65.17 89.43 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 0.0 109.07 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.5 mt -56.06 -23.54 34.13 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 120.786 -1.196 . . . . 0.0 109.168 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -78.43 -56.21 4.62 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.36 -0.838 . . . . 0.0 111.437 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.81 -39.33 91.35 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.815 -1.178 . . . . 0.0 110.132 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.7 -44.28 93.75 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.083 -1.011 . . . . 0.0 108.286 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HD1' ' HH ' ' A' ' 102' ' ' TYR . 52.9 t80 -56.21 -67.17 0.32 Allowed 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -43.17 -39.16 2.75 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 111.138 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.579 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 7.8 mt -70.66 -44.36 67.25 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 118.057 -1.457 . . . . 0.0 107.562 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.82 HG21 ' CE2' ' A' ' 102' ' ' TYR . 48.6 t -59.44 -45.05 93.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.264 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 64' ' ' ILE . 6.0 mm -68.22 -34.8 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.637 -1.289 . . . . 0.0 108.367 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.58 -26.95 35.52 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.774 -0.578 . . . . 0.0 110.358 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.9 mpt_? -90.74 -0.55 57.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.441 -1.412 . . . . 0.0 108.914 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.54 19.74 61.44 Favored Glycine 0 N--CA 1.489 2.221 0 C-N-CA 120.386 -0.912 . . . . 0.0 111.808 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.412 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 138.44 131.9 2.93 Favored Glycine 0 N--CA 1.499 2.838 0 O-C-N 120.672 -1.487 . . . . 0.0 111.418 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.553 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.1 tp -49.65 -39.54 36.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.617 -0.931 . . . . 0.0 109.914 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 122' ' ' LEU . 83.4 t -58.29 -43.22 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.212 -0.93 . . . . 0.0 109.907 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -54.99 -39.37 68.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.725 -1.234 . . . . 0.0 109.045 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.599 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.0 t -63.37 -42.11 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.49 -0.756 . . . . 0.0 109.845 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 HH11 ' A' ' 99' ' ' ARG . 72.7 mt -66.61 -58.52 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.661 -1.274 . . . . 0.0 110.454 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -56.64 -42.47 78.97 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.36 -9.46 38.73 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.22 -0.925 . . . . 0.0 110.826 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 72' ' ' VAL . 40.3 mttp 58.17 60.81 2.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.211 -0.93 . . . . 0.0 110.292 -178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 15.7 mt -93.23 16.24 13.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.017 -1.052 . . . . 0.0 108.497 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.553 ' HH2' HD11 ' A' ' 69' ' ' LEU . 82.3 m95 -64.78 -39.07 93.01 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.424 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.1 mm-40 -49.54 -38.28 30.28 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 118.425 -1.31 . . . . 0.0 108.093 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -69.26 -40.57 77.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 mt -71.75 -53.33 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.431 -0.793 . . . . 0.0 109.062 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.1 mt -51.48 -53.7 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 109.19 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -68.94 -39.15 79.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.223 -0.923 . . . . 0.0 110.201 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.7 -32.63 47.5 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.458 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 1.1 mm? -89.18 -7.95 54.61 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.385 -1.068 . . . . 0.0 108.7 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 63.96 42.34 5.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.837 -0.54 . . . . 0.0 110.331 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 142.16 83.62 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.201 -0.937 . . . . 0.0 108.934 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.582 ' C ' ' H ' ' A' ' 90' ' ' SER . 36.5 Cg_endo -69.86 143.2 49.59 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 C-N-CA 122.063 1.842 . . . . 0.0 112.456 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.7 p -55.61 -1.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.414 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.582 ' H ' ' C ' ' A' ' 88' ' ' PRO . 23.3 m -64.43 -34.19 77.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 110.154 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.552 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.0 mt -90.99 97.5 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 120.738 -1.226 . . . . 0.0 109.243 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 69.1 p -70.45 -21.92 62.75 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.284 -0.885 . . . . 0.0 109.194 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 57.9 m -104.25 43.37 1.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.467 -0.771 . . . . 0.0 109.159 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.39 -61.19 2.26 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.331 -0.856 . . . . 0.0 109.319 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.4 -50.47 30.8 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 109.807 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.403 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 7.7 tp -58.02 -46.06 85.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.765 -1.209 . . . . 0.0 109.116 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.841 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.2 m -58.92 -41.08 86.44 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.047 -1.033 . . . . 0.0 108.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.19 -44.46 68.66 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.802 . . . . 0.0 109.507 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.469 ' HG3' HH11 ' A' ' 99' ' ' ARG . 6.7 ttm-85 -65.81 -55.04 19.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.981 -1.074 . . . . 0.0 111.017 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.4 m -57.22 -52.9 63.46 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.436 -0.79 . . . . 0.0 111.003 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.66 -43.79 97.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.071 -1.018 . . . . 0.0 111.715 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.82 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.1 t80 -57.69 -39.65 77.66 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.356 -1.465 . . . . 0.0 109.595 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -54.46 -54.72 37.12 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.28 -0.888 . . . . 0.0 111.65 -178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -72.87 -52.88 13.03 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.477 -1.389 . . . . 0.0 113.198 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -84.68 -50.33 7.73 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.571 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.2 mp -97.2 6.23 48.78 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.235 -1.541 . . . . 0.0 113.863 -176.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.596 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 68.8 t80 -67.74 -37.01 10.85 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 119.955 -1.716 . . . . 0.0 111.684 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 60.6 Cg_endo -78.75 -40.98 0.26 Allowed 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 121.354 1.369 . . . . 0.0 112.096 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.54 -42.97 89.07 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -70.86 -46.04 63.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.599 -0.688 . . . . 0.0 110.072 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.1 t -77.03 -45.81 25.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.337 -0.852 . . . . 0.0 110.611 -178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.5 tp10 -66.22 -47.13 74.82 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.099 -1.001 . . . . 0.0 110.856 -178.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -76.61 -33.63 58.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.095 -1.003 . . . . 0.0 111.417 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.492 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.6 tptp -119.6 -27.43 5.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 111.783 -177.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 111' ' ' CYS . 24.1 t-20 55.76 45.34 24.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.78 -1.2 . . . . 0.0 110.389 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 114' ' ' LYS . 73.1 mt -67.24 -31.34 71.63 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.176 -0.952 . . . . 0.0 110.966 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.5 t -154.65 -167.0 2.47 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 118.746 -1.182 . . . . 0.0 111.576 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.522 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.6 p -122.06 152.67 60.34 Favored Pre-proline 0 N--CA 1.497 1.907 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.061 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.596 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 10.9 Cg_endo -55.85 -38.76 94.09 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.883 1.722 . . . . 0.0 112.092 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.95 -37.71 88.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.98 -1.075 . . . . 0.0 109.539 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.431 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.7 mt-10 -66.96 -43.42 83.15 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 103' ' ' MET . 15.6 tp -64.31 -52.92 56.11 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.536 -0.728 . . . . 0.0 109.657 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -58.62 -47.25 84.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.331 -0.855 . . . . 0.0 109.794 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.12 -38.68 87.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 110.033 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.84 -34.04 76.92 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.543 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -68.42 -45.61 81.93 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 N-CA-C 108.102 -1.074 . . . . 0.0 108.102 177.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.477 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 62.5 t0 -58.94 -40.05 83.47 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.046 -1.034 . . . . 0.0 108.799 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.14 -26.83 73.73 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 17.5 p-10 -89.49 -31.82 17.49 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.766 -1.432 . . . . 0.0 110.595 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.652 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 85.5 mtm180 -62.85 142.06 58.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.662 -1.273 . . . . 0.0 110.083 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -67.14 147.97 52.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.813 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -76.11 -4.23 40.39 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.986 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.955 0 O4'-C1'-C2' 108.406 2.096 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.102 0 O4'-C4'-C3' 107.757 2.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.848 0 O4'-C4'-C3' 107.602 2.002 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.086 0 O4'-C4'-C3' 107.863 2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O5'-C5'-C4' 112.809 1.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.939 0 O5'-C5'-C4' 113.011 2.008 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.852 0 O5'-C5'-C4' 112.927 1.948 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.569 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.182 0 O4'-C4'-C3' 107.807 2.207 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.281 0 O5'-C5'-C4' 113.105 2.075 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O4'-C4'-C3' 107.793 2.193 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.994 0 O5'-C5'-C4' 113.137 2.098 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.246 2.176 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.095 0 O4'-C4'-C3' 108.146 2.546 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.834 0 O4'-C4'-C3' 107.454 1.854 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.978 0 O4'-C4'-C3' 107.885 2.285 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.821 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.972 0 O4'-C1'-C2' 109.002 2.638 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.599 0 C4'-C3'-C2' 105.733 2.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.403 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O5'-C5'-C4' 112.784 1.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.448 0 O5'-C5'-C4' 113.7 2.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.422 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.425 -1.927 0 O4'-C4'-C3' 107.913 2.313 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.403 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O5'-C5'-C4' 113.1 2.071 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O5'-C5'-C4' 113.547 2.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 113.372 2.266 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.321 0 O4'-C1'-C2' 108.663 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.272 0 O4'-C4'-C3' 107.533 1.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 0 O5'-C5'-C4' 113.226 2.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.026 0 O5'-C5'-C4' 113.058 2.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.068 0 O4'-C4'-C3' 107.806 2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.096 0 C1'-O4'-C4' 106.282 -2.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.584 ' O ' ' N ' ' A' ' 5' ' ' SER . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.445 ' C ' ' O ' ' A' ' 3' ' ' GLY . 26.5 t90 -37.86 90.61 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.665 -0.903 . . . . 0.0 110.125 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.584 ' N ' ' O ' ' A' ' 3' ' ' GLY . 0.1 OUTLIER -107.13 135.74 48.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.267 -0.896 . . . . 0.0 109.29 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -58.59 -40.76 84.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.516 -0.74 . . . . 0.0 111.104 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.26 -42.39 98.55 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.917 -1.114 . . . . 0.0 109.898 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -50.56 -35.15 28.45 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.365 -0.835 . . . . 0.0 110.025 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.582 ' O ' HG13 ' A' ' 13' ' ' VAL . 33.7 mt-30 -69.86 -41.58 74.65 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.922 -1.111 . . . . 0.0 111.116 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -54.24 -49.54 69.24 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.694 -1.254 . . . . 0.0 110.052 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -62.02 -42.32 99.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.068 -1.02 . . . . 0.0 109.453 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.04 -47.27 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.261 -0.899 . . . . 0.0 110.891 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.582 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -72.67 -36.7 53.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 120.58 -1.325 . . . . 0.0 108.8 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -53.49 -40.44 65.36 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.45 -31.3 69.18 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.466 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -72.91 -36.33 67.24 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.462 -0.773 . . . . 0.0 111.633 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.481 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -79.05 -33.38 44.76 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.318 -1.489 . . . . 0.0 110.769 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.5 mm-40 -67.18 -26.35 66.6 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.888 -1.132 . . . . 0.0 110.528 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.474 ' C ' ' O ' ' A' ' 18' ' ' GLU . 28.7 mt -37.79 -39.55 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.617 -0.677 . . . . 0.0 110.694 -178.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -171.65 163.76 6.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.752 -1.218 . . . . 0.0 110.321 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -90.0 65.18 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.696 -0.627 . . . . 0.0 110.213 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -112.44 95.87 33.52 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.464 -0.773 . . . . 0.0 108.976 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.61 -40.16 30.2 Favored 'Trans proline' 0 N--CA 1.493 1.441 0 C-N-CA 122.358 2.038 . . . . 0.0 112.272 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -60.91 -41.1 95.46 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.02 -1.05 . . . . 0.0 108.592 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.706 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -59.79 -39.02 83.55 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.485 -0.76 . . . . 0.0 109.416 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.593 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 57.7 tttm -59.94 -50.58 73.2 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.16 -39.17 63.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -63.42 -61.86 2.06 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.486 -0.759 . . . . 0.0 109.539 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.566 HD21 HH12 ' A' ' 25' ' ' ARG . 74.7 mt -56.14 -46.73 79.13 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.345 -0.847 . . . . 0.0 109.067 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.593 ' OD2' ' NZ ' ' A' ' 26' ' ' LYS . 70.3 m-20 -62.29 -52.14 64.91 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.702 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.81 -40.87 92.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.244 -0.91 . . . . 0.0 109.188 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -57.23 -55.69 31.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.334 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.9 m-85 -60.63 -34.05 73.69 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.08 -1.448 . . . . 0.0 107.979 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -69.96 -52.95 20.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.514 -0.741 . . . . 0.0 110.614 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -60.19 -43.57 95.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 111.908 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 98.1 mtp -57.86 -34.36 69.67 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.095 -1.003 . . . . 0.0 111.123 -178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -54.12 -40.18 67.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.622 -1.299 . . . . 0.0 108.169 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -67.21 -37.53 83.78 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.469 -0.769 . . . . 0.0 109.358 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.418 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.6 mmm180 -63.5 -31.66 72.88 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.729 -0.607 . . . . 0.0 109.602 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.41 -2.96 61.2 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 108.238 -1.945 . . . . 0.0 108.238 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 39.6 p -118.99 85.18 28.41 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -83.49 144.6 11.48 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.58 2.187 . . . . 0.0 111.666 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.454 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 8.9 mt -77.13 94.07 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.109 -0.995 . . . . 0.0 109.264 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -61.0 -35.33 76.57 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.617 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -148.44 136.04 20.61 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.466 HD13 ' CD1' ' A' ' 16' ' ' LEU . 1.7 mt -71.45 145.49 90.43 Favored Pre-proline 0 C--N 1.297 -1.692 0 O-C-N 120.987 -1.071 . . . . 0.0 109.003 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -67.39 133.69 31.05 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 N-CA-C 108.982 -1.199 . . . . 0.0 108.982 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.517 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 5.7 mt -101.59 145.51 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.887 -1.133 . . . . 0.0 109.945 -178.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.739 ' SD ' HD13 ' A' ' 54' ' ' LEU . 81.3 mtp -144.67 118.74 9.42 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 73.15 37.98 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mttt 57.79 25.15 11.59 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.639 0.733 . . . . 0.0 109.29 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 93.3 p -136.85 154.87 50.39 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.3 m -68.04 145.32 13.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.176 -0.953 . . . . 0.0 109.076 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.739 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.8 tp -77.92 123.61 27.0 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.306 -0.872 . . . . 0.0 109.512 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -62.89 88.51 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.8 mt -53.96 -25.43 20.65 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.87 -1.144 . . . . 0.0 108.957 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -78.86 -52.69 7.97 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.342 -0.849 . . . . 0.0 111.984 -178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -64.38 -37.34 87.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.556 -1.34 . . . . 0.0 110.165 -178.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 98' ' ' LEU . 56.4 tp -58.79 -44.03 90.62 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.969 ' CE1' HD11 ' A' ' 64' ' ' ILE . 56.6 t80 -56.36 -73.66 0.06 Allowed 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -39.36 -41.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.257 -0.902 . . . . 0.0 111.782 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mt -71.46 -44.48 64.71 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 117.943 -1.503 . . . . 0.0 107.945 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.682 HG21 ' CE2' ' A' ' 102' ' ' TYR . 19.1 t -59.34 -46.69 92.3 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.164 179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.969 HD11 ' CE1' ' A' ' 60' ' ' TYR . 5.5 mm -68.99 -35.59 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.769 -1.207 . . . . 0.0 107.843 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.415 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.57 -23.0 9.5 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.628 -178.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.521 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.4 mpt_? -92.26 -1.94 56.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.648 -1.283 . . . . 0.0 108.782 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.48 19.47 64.07 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.166 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.07 127.54 2.23 Favored Glycine 0 N--CA 1.5 2.929 0 CA-C-N 119.596 1.698 . . . . 0.0 111.846 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.567 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.7 tp -46.91 -39.39 12.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.586 -0.95 . . . . 0.0 109.526 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.6 t -59.43 -42.1 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.223 -0.923 . . . . 0.0 109.656 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -55.01 -42.7 72.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.036 -1.04 . . . . 0.0 109.47 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 76' ' ' LYS . 22.5 t -63.28 -43.42 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.468 -0.77 . . . . 0.0 110.201 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -64.95 -56.72 14.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 O-C-N 120.813 -1.179 . . . . 0.0 110.45 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -57.38 -41.94 81.18 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -93.6 -9.91 36.45 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.029 -1.044 . . . . 0.0 110.436 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 72' ' ' VAL . 38.6 mtmt 58.73 59.96 2.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.441 -0.787 . . . . 0.0 109.772 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.3 mt -93.01 14.38 17.89 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.189 -0.945 . . . . 0.0 108.663 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.8 m95 -62.27 -39.38 92.73 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.43 ' NE2' ' OP2' ' C' ' 419' ' ' ' DC' . 87.6 mm-40 -49.08 -39.29 27.38 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.722 -1.236 . . . . 0.0 108.386 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HB3' HH21 ' A' ' 66' ' ' ARG . 77.1 mm-40 -69.83 -39.54 76.4 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt -71.08 -54.87 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.295 -0.878 . . . . 0.0 108.881 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.622 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.1 mt -51.24 -55.61 7.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -68.41 -36.8 79.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.063 -1.023 . . . . 0.0 109.206 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.45 -34.99 49.95 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.6 mt -88.27 -7.25 57.06 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.351 -1.088 . . . . 0.0 108.667 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 66.54 40.58 3.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.236 0.541 . . . . 0.0 110.004 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.43 142.87 81.92 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.939 . . . . 0.0 108.545 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.563 ' C ' ' H ' ' A' ' 90' ' ' SER . 42.3 Cg_endo -70.34 144.28 50.46 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.142 1.895 . . . . 0.0 112.301 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 p -57.57 -0.35 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.205 -0.935 . . . . 0.0 109.486 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 88' ' ' PRO . 13.8 m -65.01 -30.74 71.74 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.354 -0.841 . . . . 0.0 109.844 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.429 HD11 ' N ' ' A' ' 50' ' ' ALA . 70.8 mt -93.81 97.54 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 120.656 -1.278 . . . . 0.0 109.274 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.6 p -71.87 -25.0 61.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.938 . . . . 0.0 109.345 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 m -101.88 41.77 1.19 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.64 -59.58 3.02 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.349 -0.845 . . . . 0.0 109.252 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.622 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.22 -52.6 15.44 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.152 -0.967 . . . . 0.0 109.038 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.46 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.0 tp -58.63 -44.63 90.07 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.06 -1.025 . . . . 0.0 109.214 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.3 m -60.2 -40.27 89.47 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.116 -0.99 . . . . 0.0 108.903 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 59' ' ' LEU . 9.6 mt -68.77 -46.08 69.69 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.614 -0.679 . . . . 0.0 109.786 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.671 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 37.4 ttm180 -64.94 -51.42 61.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.333 -0.854 . . . . 0.0 110.884 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -54.69 -54.75 37.69 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.671 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -62.59 -42.0 99.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 0.0 111.559 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.682 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.2 t80 -58.02 -43.33 86.64 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 120.207 -1.558 . . . . 0.0 109.256 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.705 ' HG2' HD21 ' A' ' 122' ' ' LEU . 85.3 mtp -53.36 -57.43 10.62 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.734 -0.604 . . . . 0.0 112.325 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -72.82 -51.26 19.6 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.671 -1.268 . . . . 0.0 112.79 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.4 ' C ' HD12 ' A' ' 106' ' ' LEU . 71.2 m-85 -84.27 -47.41 10.8 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.545 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.5 mp -98.86 -1.43 40.18 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.33 -1.481 . . . . 0.0 114.035 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.643 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 81.1 t80 -63.12 -36.86 27.19 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 119.746 -1.846 . . . . 0.0 110.337 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.643 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.2 Cg_exo -67.07 -56.39 0.24 Allowed 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.145 1.896 . . . . 0.0 111.855 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.76 -43.44 85.45 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -72.95 -49.9 26.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.301 -0.874 . . . . 0.0 110.641 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.4 t -76.8 -43.05 38.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.156 -0.965 . . . . 0.0 111.199 -178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.5 tp10 -68.8 -50.35 50.93 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.577 -1.327 . . . . 0.0 110.996 -178.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -74.0 -35.76 64.44 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.115 -0.991 . . . . 0.0 111.699 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.2 tptp -111.02 -29.04 8.06 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.838 -1.163 . . . . 0.0 111.612 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 54.61 44.67 28.3 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.643 -1.286 . . . . 0.0 110.607 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.662 HD11 HG23 ' A' ' 64' ' ' ILE . 73.5 mt -66.07 -30.88 71.48 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.117 -0.989 . . . . 0.0 110.398 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -154.24 -166.7 2.43 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.406 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 74.2 p -127.53 159.81 63.82 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.595 -0.691 . . . . 0.0 109.753 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.45 -39.28 90.24 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.613 1.542 . . . . 0.0 112.256 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.59 -37.95 89.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.969 -1.082 . . . . 0.0 109.775 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -66.4 -44.73 82.2 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD21 ' HG2' ' A' ' 103' ' ' MET . 26.6 tp -66.66 -51.72 53.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.349 0.595 . . . . 0.0 110.08 179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -57.74 -47.02 83.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.0 109.863 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.13 91.91 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.238 -0.914 . . . . 0.0 109.877 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.96 -34.33 75.15 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.939 0.876 . . . . 0.0 108.7 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.7 HD11 ' SD ' ' A' ' 103' ' ' MET . 13.2 mt -63.59 -52.24 60.12 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -61.74 -36.85 82.17 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.458 -0.897 . . . . 0.0 109.04 179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.84 -31.64 81.08 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.671 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 3.9 p30 -90.92 -35.62 14.62 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.055 -1.262 . . . . 0.0 111.183 -178.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.502 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 72.7 mtm180 -62.6 143.52 57.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.714 -1.241 . . . . 0.0 110.203 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.552 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.4 mpt_? -70.9 166.54 20.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.633 -0.667 . . . . 0.0 109.935 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -104.35 110.06 22.16 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.365 -0.834 . . . . 0.0 109.29 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.459 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.832 0 O4'-C1'-C2' 108.399 2.09 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.577 0 O4'-C4'-C3' 107.783 2.183 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C4'-C3' 107.338 1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.077 0 O5'-C5'-C4' 113.271 2.194 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.716 0 O4'-C4'-C3' 107.556 1.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.727 0 O4'-C4'-C3' 107.72 2.12 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . 0.506 ' P ' ' HE ' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.607 1.387 0 O4'-C4'-C3' 107.289 1.689 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.517 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.172 0 O4'-C4'-C3' 107.825 2.225 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . 0.464 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.301 0 O5'-C5'-C4' 113.381 2.272 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.414 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O5'-C5'-C4' 113.478 2.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O5'-C5'-C4' 112.953 1.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.066 0 O5'-C5'-C4' 113.712 2.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.964 0 O4'-C4'-C3' 107.29 1.69 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.968 0 O4'-C4'-C3' 107.964 2.364 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.435 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.42 -2.373 0 C4'-C3'-C2' 104.686 1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.435 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.14 0 O4'-C4'-C3' 108.045 2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.801 0 O5'-C5'-C4' 112.63 1.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.43 ' OP2' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 O4'--C4' 1.429 -1.536 0 O5'-C5'-C4' 113.581 2.415 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.411 ' OP1' ' OD1' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.855 0 O4'-C4'-C3' 107.871 2.271 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.469 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.259 0 O5'-C5'-C4' 113.236 2.168 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.469 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O5'-C5'-C4' 113.578 2.413 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . 0.464 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.079 0 O5'-C5'-C4' 113.181 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.387 0 O4'-C1'-C2' 108.727 2.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O5'-C5'-C4' 113.375 2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.341 0 O4'-C4'-C3' 107.542 1.942 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.505 0 O5'-C5'-C4' 113.316 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.975 0 O5'-C5'-C4' 112.906 1.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O4'-C4'-C3' 107.8 2.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.061 0 C1'-O4'-C4' 106.577 -2.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.571 ' CG ' ' OD1' ' A' ' 44' ' ' ASN . 24.4 p90 -71.2 157.49 38.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.185 -1.185 . . . . 0.0 109.384 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.478 ' OG ' ' OE1' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -91.72 130.94 37.42 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.19 -0.944 . . . . 0.0 110.41 -178.962 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -55.95 -33.96 65.22 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.808 -0.557 . . . . 0.0 109.876 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.478 ' OE1' ' OG ' ' A' ' 5' ' ' SER . 57.8 mp0 -63.29 -42.01 99.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.042 -1.037 . . . . 0.0 108.801 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -58.58 -46.42 86.98 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.409 -0.807 . . . . 0.0 109.755 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.752 ' O ' HG13 ' A' ' 13' ' ' VAL . 1.8 mp0 -66.2 -39.33 89.56 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.039 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.17 -50.82 70.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.405 -0.809 . . . . 0.0 109.322 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.66 -41.66 99.18 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.055 -1.028 . . . . 0.0 109.213 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.58 -48.16 75.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.337 -0.852 . . . . 0.0 110.586 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.0 m -69.68 -37.15 73.34 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 120.674 -1.266 . . . . 0.0 107.796 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -54.52 -41.52 69.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 mm-40 -58.95 -29.91 67.49 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.304 -0.958 . . . . 0.0 108.762 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 46' ' ' LEU . 8.9 mt -72.42 -38.45 68.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 111.333 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.44 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.0 m-85 -76.67 -33.53 58.27 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.509 -1.369 . . . . 0.0 110.457 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.3 mt-10 -65.72 -26.92 67.97 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.844 -1.16 . . . . 0.0 110.325 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.598 HG21 HH12 ' A' ' 25' ' ' ARG . 32.9 mt -38.39 -40.28 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 O-C-N 121.604 -0.685 . . . . 0.0 110.665 -179.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -170.74 164.45 8.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.744 -1.223 . . . . 0.0 110.758 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -89.84 68.38 7.41 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.396 0.617 . . . . 0.0 109.774 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -112.44 94.28 26.57 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.13 -41.72 40.61 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.01 1.807 . . . . 0.0 111.974 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -63.38 -41.72 98.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.107 -0.996 . . . . 0.0 108.611 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.598 HH12 HG21 ' A' ' 19' ' ' ILE . 66.3 ttt180 -58.68 -37.78 76.79 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.432 -0.793 . . . . 0.0 109.297 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.74 -49.35 78.06 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.359 -0.838 . . . . 0.0 108.845 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.62 -37.75 65.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.554 -0.716 . . . . 0.0 109.365 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.48 -61.22 2.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.269 -0.894 . . . . 0.0 110.695 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.45 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 54.7 mt -54.7 -47.56 73.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.284 -0.885 . . . . 0.0 109.295 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.44 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 88.1 m-20 -62.13 -46.17 90.19 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.821 -0.752 . . . . 0.0 109.395 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -67.1 -44.42 80.04 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.189 -0.944 . . . . 0.0 109.389 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.8 tp -55.56 -51.26 67.68 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.429 -0.795 . . . . 0.0 109.924 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.9 m-85 -61.0 -34.83 75.42 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 118.442 -1.303 . . . . 0.0 107.85 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -70.78 -52.84 18.08 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.559 -0.713 . . . . 0.0 110.524 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.68 -45.04 90.29 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.271 -0.893 . . . . 0.0 111.124 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.6 mtp -58.38 -33.57 69.75 Favored 'General case' 0 C--N 1.296 -1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.22 -179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -52.78 -39.12 61.99 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.96 -1.087 . . . . 0.0 108.652 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 38' ' ' LYS . 39.3 mmtt -71.03 -37.35 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -65.21 -30.45 71.35 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.76 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.73 0.74 64.11 Favored Glycine 0 N--CA 1.485 1.965 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.5 p -117.21 84.81 17.86 Favored Pre-proline 0 N--CA 1.491 1.58 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -83.77 141.14 9.53 Favored 'Trans proline' 0 C--N 1.301 -1.945 0 C-N-CA 122.507 2.138 . . . . 0.0 111.4 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.4 mt -76.36 97.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.997 -1.064 . . . . 0.0 109.725 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.571 ' OD1' ' CG ' ' A' ' 4' ' ' TRP . 24.5 t-20 -68.15 -45.94 72.18 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.414 ' NH1' H5'' ' B' ' 406' ' ' ' DA' . 16.5 mtm180 -130.03 132.16 46.12 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 16' ' ' LEU . 17.7 mt -70.17 128.3 91.61 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 120.889 -1.132 . . . . 0.0 109.879 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -53.32 126.35 21.37 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 N-CA-C 108.777 -1.278 . . . . 0.0 108.777 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.6 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 51.2 mt -99.34 142.28 15.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.946 -1.096 . . . . 0.0 110.187 -178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.647 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.6 mtp -137.99 124.43 20.7 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.77 40.42 3.21 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 57.27 22.84 8.11 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.332 0.587 . . . . 0.0 110.286 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.1 p -136.08 153.42 51.33 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.187 -0.946 . . . . 0.0 109.079 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -66.74 145.62 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.984 -1.072 . . . . 0.0 108.941 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.647 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.6 tp -80.14 124.44 28.78 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.271 -0.893 . . . . 0.0 110.023 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.592 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.0 m-20 -63.73 88.59 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -52.42 -24.86 8.55 Favored 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.883 -1.136 . . . . 0.0 109.235 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -80.3 -57.86 3.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.237 -0.914 . . . . 0.0 111.938 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -56.81 -38.24 72.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.525 -1.359 . . . . 0.0 109.34 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.51 HD22 HD21 ' A' ' 54' ' ' LEU . 60.0 tp -58.75 -52.4 65.86 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.419 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -51.91 -66.36 0.4 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.374 0.607 . . . . 0.0 109.832 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -42.83 -43.11 3.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.508 -0.745 . . . . 0.0 111.636 -178.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.49 -40.75 70.02 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.136 -1.426 . . . . 0.0 107.402 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.787 HG21 ' CE2' ' A' ' 102' ' ' TYR . 44.1 t -60.99 -45.5 98.41 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 C-N-CA 119.611 -0.836 . . . . 0.0 109.516 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.419 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.9 mm -68.75 -45.97 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.747 -1.22 . . . . 0.0 107.886 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -4.66 2.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.807 -0.558 . . . . 0.0 109.683 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.682 ' HG3' HD13 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -101.89 9.39 40.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.103 -0.998 . . . . 0.0 108.841 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.51 7.85 87.72 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.348 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 122.8 142.63 6.21 Favored Glycine 0 N--CA 1.501 2.989 0 O-C-N 121.015 -1.285 . . . . 0.0 110.999 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' OE2' ' A' ' 110' ' ' GLU . 14.8 tp -52.18 -41.41 62.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.714 -0.874 . . . . 0.0 110.77 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.481 HG11 ' HB3' ' A' ' 121' ' ' GLU . 76.2 t -57.25 -41.76 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.747 -1.221 . . . . 0.0 108.916 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -59.07 -38.79 80.28 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.936 -1.102 . . . . 0.0 109.381 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.2 t -61.8 -46.86 95.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.329 -0.857 . . . . 0.0 110.208 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.9 mt -63.9 -61.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.072 -1.018 . . . . 0.0 109.979 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -58.89 -41.33 86.9 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.577 -0.702 . . . . 0.0 110.831 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -93.2 -7.36 45.45 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.978 -1.076 . . . . 0.0 110.985 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 72' ' ' VAL . 22.6 mtmt 57.4 56.99 4.66 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.125 -0.985 . . . . 0.0 110.492 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.682 HD13 ' HG3' ' A' ' 66' ' ' ARG . 18.2 mt -89.53 13.11 14.71 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.4 m95 -62.42 -42.86 99.76 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.635 -0.666 . . . . 0.0 109.362 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.3 mm-40 -49.69 -38.32 32.53 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.806 -1.184 . . . . 0.0 108.33 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.581 ' OE1' ' NE ' ' A' ' 66' ' ' ARG . 98.6 mt-10 -68.92 -40.48 79.03 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -72.47 -54.28 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.473 -0.767 . . . . 0.0 109.172 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.51 HD11 ' HB2' ' A' ' 95' ' ' ALA . 73.1 mt -53.15 -52.87 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 121.26 -0.9 . . . . 0.0 109.219 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -69.27 -40.28 77.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 109.344 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.73 -33.73 42.81 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.8 mt -87.66 -8.32 56.31 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.376 -1.073 . . . . 0.0 108.851 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 65.26 39.89 5.15 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.4 mt -73.03 139.71 79.91 Favored Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.338 -0.851 . . . . 0.0 108.752 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.6 Cg_endo -67.26 142.57 61.06 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.946 1.764 . . . . 0.0 111.892 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -61.37 1.16 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.268 -0.895 . . . . 0.0 109.826 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 88' ' ' PRO . 60.4 p -65.65 -24.31 67.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.263 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.483 HD11 ' H ' ' A' ' 50' ' ' ALA . 90.9 mt -98.13 106.31 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.957 -1.089 . . . . 0.0 109.001 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -78.5 -22.57 47.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.107 -0.995 . . . . 0.0 108.657 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 27.8 m -95.49 34.29 1.48 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.01 -65.9 0.62 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.067 -1.021 . . . . 0.0 108.854 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.51 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.66 -52.85 27.97 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.304 -0.873 . . . . 0.0 109.52 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.488 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.4 tp -58.53 -44.29 89.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.861 -1.149 . . . . 0.0 109.044 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 m -61.79 -40.96 97.03 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 120.942 -1.099 . . . . 0.0 109.441 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.501 HD22 HD13 ' A' ' 59' ' ' LEU . 9.4 mt -68.38 -45.83 71.66 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.399 -0.813 . . . . 0.0 110.298 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.623 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 34.9 ttp180 -64.45 -49.85 69.85 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.136 -0.978 . . . . 0.0 110.622 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -56.16 -54.82 40.59 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.112 -0.992 . . . . 0.0 109.804 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -62.58 -42.59 99.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.063 -1.023 . . . . 0.0 111.024 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.787 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -56.97 -43.17 81.36 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 120.441 -1.412 . . . . 0.0 109.44 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.66 ' CE ' HD11 ' A' ' 126' ' ' ILE . 42.5 mtt -54.32 -53.9 47.59 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.491 -0.755 . . . . 0.0 111.185 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.1 mttm -72.25 -57.14 4.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.895 -1.128 . . . . 0.0 112.47 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -83.02 -15.09 52.49 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -175.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 mt -137.17 17.87 2.98 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 120.082 -1.636 . . . . 0.0 112.893 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.631 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 37.6 t80 -72.08 -35.01 3.17 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 120.153 -1.592 . . . . 0.0 110.617 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.9 Cg_endo -83.79 -39.06 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.757 1.638 . . . . 0.0 112.799 -179.014 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.61 -41.55 86.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.625 -1.297 . . . . 0.0 107.857 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.469 ' OE2' ' N ' ' A' ' 69' ' ' LEU . 79.0 tt0 -71.86 -50.79 26.39 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.538 -0.726 . . . . 0.0 110.067 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.578 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -74.92 -44.0 51.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.496 -0.753 . . . . 0.0 111.083 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 38.8 tp10 -66.08 -47.36 74.53 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.901 -1.124 . . . . 0.0 110.605 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -74.87 -33.94 62.16 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.162 -0.961 . . . . 0.0 111.163 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG2' HD21 ' A' ' 116' ' ' LEU . 32.8 tptt -120.52 -27.98 5.04 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.186 -0.946 . . . . 0.0 111.848 -177.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.578 ' N ' ' O ' ' A' ' 111' ' ' CYS . 35.5 t-20 57.25 44.91 21.25 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.564 -1.335 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.458 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.5 mt -67.52 -30.39 70.03 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.201 -0.937 . . . . 0.0 111.249 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.577 ' OG ' ' N ' ' A' ' 118' ' ' THR . 8.8 t -153.13 -169.1 3.22 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 118.553 -1.259 . . . . 0.0 111.743 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.577 ' N ' ' OG ' ' A' ' 117' ' ' SER . 70.1 p -126.47 163.23 41.85 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.754 -0.592 . . . . 0.0 109.643 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.6 -37.95 85.08 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 121.571 1.514 . . . . 0.0 111.971 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.54 -36.72 83.51 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.995 . . . . 0.0 109.037 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.481 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.5 mt-10 -66.87 -48.78 67.71 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.603 HD11 ' CE ' ' A' ' 103' ' ' MET . 56.5 tp -57.54 -58.01 10.18 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.525 -0.735 . . . . 0.0 109.974 178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 126' ' ' ILE . 18.0 mm100 -56.8 -45.71 82.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.496 -0.753 . . . . 0.0 109.394 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.13 -36.5 77.65 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.802 -1.186 . . . . 0.0 108.466 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.18 -35.91 74.29 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.66 HD11 ' CE ' ' A' ' 103' ' ' MET . 19.3 mt -60.14 -52.5 60.58 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -64.31 -38.03 89.58 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.01 -30.25 69.71 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.85 -32.88 13.05 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.846 -1.385 . . . . 0.0 110.94 -178.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.72 HH22 ' P ' ' C' ' 421' ' ' ' DT' . 0.0 OUTLIER -61.45 143.61 55.57 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.773 -1.204 . . . . 0.0 109.362 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.555 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 0.3 OUTLIER -75.15 151.83 38.51 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.557 -0.714 . . . . 0.0 110.335 -179.407 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -91.29 105.25 17.65 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.295 -0.878 . . . . 0.0 108.736 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.74 0 O4'-C1'-C2' 108.203 1.912 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.283 0 O4'-C4'-C3' 107.701 2.101 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.86 0 O4'-C4'-C3' 107.484 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.273 0 O4'-C4'-C3' 107.837 2.237 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.703 0 O4'-C4'-C3' 107.612 2.012 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . 0.414 H5'' ' NH1' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.723 0 O4'-C4'-C3' 107.567 1.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.784 0 O4'-C4'-C3' 107.688 2.088 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.6 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.522 1.345 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.107 0 O5'-C5'-C4' 113.027 2.019 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.437 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C1'-C2' 108.634 2.304 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.437 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.047 0 O5'-C5'-C4' 113.266 2.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.746 0 O5'-C5'-C4' 113.23 2.164 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.745 0 O4'-C4'-C3' 107.803 2.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 0 O4'-C4'-C3' 107.338 1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.463 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.422 -2.156 0 C4'-C3'-C2' 104.675 1.475 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 2.048 0 O4'-C1'-C2' 108.877 2.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O5'-C5'-C4' 112.76 1.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.545 ' O2 ' ' NH2' ' A' ' 131' ' ' ARG . . . . . . . . 0 P--O5' 1.609 1.574 0 O5'-C5'-C4' 113.623 2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.56 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 107.641 2.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.72 ' P ' HH22 ' A' ' 130' ' ' ARG . . . . . . . . 0 P--O5' 1.616 2.28 0 O5'-C5'-C4' 113.085 2.06 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.289 0 O5'-C5'-C4' 113.483 2.345 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.82 2.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-C2' 108.827 2.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.116 0 O4'-C4'-C3' 108.157 2.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C4'-C3' 107.637 2.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.452 0 O4'-C4'-C3' 107.657 2.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.85 0 O5'-C5'-C4' 112.804 1.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O4'-C4'-C3' 107.781 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.046 0 C1'-O4'-C4' 106.402 -2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.474 ' CE2' ' OD1' ' A' ' 44' ' ' ASN . 47.1 p90 -63.99 151.71 42.09 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.221 -1.164 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.9 136.03 35.71 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.374 -0.829 . . . . 0.0 109.683 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -56.17 -38.58 71.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.599 -0.688 . . . . 0.0 110.122 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -64.44 -41.75 96.38 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.031 -1.043 . . . . 0.0 109.261 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -55.15 -42.96 73.76 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.256 -0.902 . . . . 0.0 109.676 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.9 mm100 -67.26 -39.1 86.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.955 . . . . 0.0 109.253 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.65 ' CZ ' ' NE ' ' A' ' 14' ' ' ARG . 52.4 t80 -54.91 -50.18 69.44 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.29 -0.881 . . . . 0.0 108.95 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -62.86 -40.78 98.55 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.025 -1.047 . . . . 0.0 109.59 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.65 -47.98 73.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.832 . . . . 0.0 111.006 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.697 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -70.11 -38.06 73.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 120.702 -1.249 . . . . 0.0 108.992 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.65 ' NE ' ' CZ ' ' A' ' 10' ' ' PHE . 7.7 mmt-85 -55.91 -39.82 72.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.392 -1.443 . . . . 0.0 108.347 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -58.71 -29.0 66.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.453 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -75.32 -39.51 59.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.404 -0.81 . . . . 0.0 111.634 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.4 m-85 -74.86 -34.16 62.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.5 -1.375 . . . . 0.0 110.578 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 19' ' ' ILE . 77.8 mm-40 -64.77 -26.99 68.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.923 -1.111 . . . . 0.0 110.154 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.49 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 41.8 mt -39.87 -40.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.72 -0.612 . . . . 0.0 110.652 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.49 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.4 m120 -171.13 160.95 6.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.716 -1.24 . . . . 0.0 110.448 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 52.3 p30 -91.65 64.42 4.9 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.49 0.662 . . . . 0.0 109.724 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.0 107.66 60.83 Favored Pre-proline 0 N--CA 1.489 1.502 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -46.87 -51.78 8.68 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.031 1.821 . . . . 0.0 112.513 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.16 -36.1 78.89 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.169 -0.957 . . . . 0.0 109.337 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.688 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -59.41 -44.97 92.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -62.32 -53.27 57.51 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.308 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -51.69 -37.67 51.75 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.525 -0.735 . . . . 0.0 109.208 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -62.01 -62.58 1.69 Allowed 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.468 -0.77 . . . . 0.0 110.318 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.495 HD11 ' NH1' ' A' ' 25' ' ' ARG . 57.5 mt -54.77 -45.45 74.24 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.487 -0.758 . . . . 0.0 109.148 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -61.73 -47.64 84.3 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.035 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -66.68 -44.82 80.75 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.415 -0.803 . . . . 0.0 109.762 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.43 -51.74 67.25 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.349 -0.844 . . . . 0.0 110.898 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.415 ' CE1' HD12 ' A' ' 43' ' ' ILE . 42.0 m-85 -62.53 -33.06 74.15 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 118.104 -1.438 . . . . 0.0 108.207 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 m -68.99 -55.03 12.13 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.408 -0.807 . . . . 0.0 110.203 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.438 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 46.3 t80 -61.91 -38.45 88.43 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.894 . . . . 0.0 111.656 -178.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.5 mmm -58.22 -34.79 70.8 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.857 -1.152 . . . . 0.0 110.748 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -56.27 -37.63 70.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.772 -1.205 . . . . 0.0 109.25 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.1 -28.47 57.53 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 13.6 mmm180 -66.7 -32.05 73.1 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.733 -0.787 . . . . 0.0 109.428 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.55 -2.21 62.49 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.725 -2.15 . . . . 0.0 107.725 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.8 p -118.72 84.9 26.18 Favored Pre-proline 0 N--CA 1.49 1.545 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.17 12.34 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.527 2.151 . . . . 0.0 111.207 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.504 HG21 HD23 ' A' ' 46' ' ' LEU . 59.1 mt -80.82 99.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.048 -1.032 . . . . 0.0 110.042 -178.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.474 ' OD1' ' CE2' ' A' ' 4' ' ' TRP . 83.7 m-20 -79.11 -3.96 47.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.25 -0.906 . . . . 0.0 108.648 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -176.45 123.2 0.16 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.279 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD23 HG21 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -70.29 144.06 91.66 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 120.953 -1.092 . . . . 0.0 108.93 -179.368 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -67.08 138.85 48.89 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 121.501 1.467 . . . . 0.0 109.558 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.588 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 35.3 mt -105.55 142.69 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.02 -1.05 . . . . 0.0 110.269 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.58 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.3 mtp -134.52 125.71 27.89 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.49 40.03 8.59 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.5 mttt 58.94 25.02 13.22 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.857 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.547 ' N ' HG23 ' A' ' 48' ' ' ILE . 84.8 p -137.56 154.58 49.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.369 -0.832 . . . . 0.0 109.524 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.26 144.3 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.197 -0.939 . . . . 0.0 109.975 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.695 HD21 HD22 ' A' ' 59' ' ' LEU . 51.0 tp -77.16 122.63 25.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.544 -0.722 . . . . 0.0 109.396 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -61.86 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.656 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.28 -26.87 42.86 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 120.92 -1.112 . . . . 0.0 109.149 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -78.1 -63.46 1.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.136 -0.978 . . . . 0.0 111.564 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -57.1 -38.73 73.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.684 -1.26 . . . . 0.0 110.267 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.695 HD22 HD21 ' A' ' 54' ' ' LEU . 39.9 tp -58.72 -43.47 90.14 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.546 -1.346 . . . . 0.0 107.853 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.586 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 55.2 t80 -60.03 -67.5 0.38 Allowed 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.412 0.625 . . . . 0.0 109.547 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -41.94 -41.4 2.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.515 -0.74 . . . . 0.0 111.429 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.1 -44.07 69.74 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.12 -1.432 . . . . 0.0 107.743 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.827 HG21 ' CE2' ' A' ' 102' ' ' TYR . 23.5 t -58.14 -45.22 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.393 -0.817 . . . . 0.0 110.403 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.586 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.1 mm -71.01 -33.43 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 120.735 -1.228 . . . . 0.0 108.313 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.47 -24.38 20.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.646 -178.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.496 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.9 mpt_? -92.46 -2.55 56.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.809 -1.182 . . . . 0.0 108.799 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.1 16.74 66.55 Favored Glycine 0 N--CA 1.491 2.312 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.434 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 145.28 128.11 2.0 Allowed Glycine 0 N--CA 1.498 2.801 0 CA-C-N 119.675 1.737 . . . . 0.0 111.85 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.616 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.9 tp -46.92 -38.33 10.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.63 -0.924 . . . . 0.0 109.695 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 88.0 t -60.61 -41.19 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.455 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -58.61 -42.99 89.46 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.878 -1.139 . . . . 0.0 109.695 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 76' ' ' LYS . 61.9 t -59.68 -43.43 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 109.349 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -66.84 -56.89 12.13 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 120.851 -1.156 . . . . 0.0 109.623 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.463 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.7 m-20 -57.79 -41.77 82.8 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.161 -0.962 . . . . 0.0 110.312 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -92.27 -9.58 41.55 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.178 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.616 ' N ' ' O ' ' A' ' 72' ' ' VAL . 28.3 mtmt 58.03 57.7 3.94 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -0.868 . . . . 0.0 109.67 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 12.6 mt -92.98 16.6 12.33 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.949 -1.094 . . . . 0.0 108.52 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.1 m95 -64.26 -39.75 94.59 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.439 ' C ' ' O ' ' A' ' 78' ' ' TRP . 16.3 mm100 -48.81 -38.88 23.38 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.287 -1.365 . . . . 0.0 108.026 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.496 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.8 mm-40 -69.64 -40.92 76.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.83 -54.47 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.776 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.5 mt -50.33 -54.2 9.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -68.4 -38.49 81.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.77 -34.0 50.16 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.1 mt -88.13 -8.33 55.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.35 -1.088 . . . . 0.0 108.823 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 66.25 39.5 4.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.781 -0.575 . . . . 0.0 109.934 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.0 mt -73.79 146.74 85.86 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.547 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.7 Cg_endo -74.04 139.96 27.69 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 C-N-CA 122.081 1.854 . . . . 0.0 112.149 179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.1 p -56.38 -0.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.822 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.547 ' H ' ' C ' ' A' ' 88' ' ' PRO . 86.8 p -67.31 -24.2 65.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.157 -0.964 . . . . 0.0 110.12 -178.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 94' ' ' ALA . 81.5 mt -96.99 102.01 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 120.751 -1.218 . . . . 0.0 109.274 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 52.3 p -73.43 -28.04 61.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 108.899 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.447 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 69.4 m -92.04 30.51 1.41 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -61.83 -65.55 0.67 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.287 -0.883 . . . . 0.0 108.684 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.776 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.37 -51.27 35.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 109.178 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.589 HD22 ' C7 ' ' C' ' 421' ' ' ' DT' . 5.5 tp -59.04 -42.71 90.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.976 -1.077 . . . . 0.0 108.756 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 52.2 m -60.99 -40.84 95.03 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.246 -0.909 . . . . 0.0 108.707 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -69.29 -48.18 62.4 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.608 -0.682 . . . . 0.0 109.929 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -65.89 -49.03 69.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.144 -0.973 . . . . 0.0 110.919 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -55.83 -54.73 40.95 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 109.846 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.7 -40.9 98.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.274 -0.891 . . . . 0.0 111.115 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.827 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.78 -41.05 81.24 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.454 -1.404 . . . . 0.0 109.571 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.586 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.1 ttm -53.65 -54.1 42.6 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.426 -0.796 . . . . 0.0 111.552 -178.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -72.0 -54.5 9.72 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.661 -1.275 . . . . 0.0 113.164 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -85.41 -44.59 12.63 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 102' ' ' TYR . 3.0 mt -97.96 -7.69 29.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.315 -1.49 . . . . 0.0 114.231 -175.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.8 t80 -59.87 -38.18 57.48 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 119.84 -1.788 . . . . 0.0 109.209 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 15.8 Cg_exo -67.71 -52.07 0.6 Allowed 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.333 2.022 . . . . 0.0 112.036 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -60.67 -38.45 84.98 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.612 ' CG ' HD12 ' A' ' 116' ' ' LEU . 59.7 tt0 -73.33 -52.2 14.72 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.619 -0.676 . . . . 0.0 109.95 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 73.0 m -71.24 -43.87 66.42 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.475 -0.766 . . . . 0.0 110.888 -178.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -67.77 -47.12 70.07 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.018 -1.051 . . . . 0.0 111.407 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt -74.78 -33.59 62.29 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.99 -1.069 . . . . 0.0 112.145 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.47 -25.13 3.78 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.853 -1.154 . . . . 0.0 111.641 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 60.64 48.76 7.0 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.687 -1.258 . . . . 0.0 110.285 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.612 HD12 ' CG ' ' A' ' 110' ' ' GLU . 18.5 mt -67.1 -33.85 76.35 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.106 -0.996 . . . . 0.0 111.264 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.556 ' OG ' ' N ' ' A' ' 118' ' ' THR . 26.6 t -155.43 -166.62 2.3 Favored 'General case' 0 N--CA 1.496 1.828 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.315 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.556 ' N ' ' OG ' ' A' ' 117' ' ' SER . 69.7 p -130.6 156.76 79.26 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.562 -0.711 . . . . 0.0 110.078 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -51.72 -42.82 54.92 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 121.906 1.737 . . . . 0.0 112.493 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.98 -38.96 93.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.743 -1.223 . . . . 0.0 109.512 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -65.64 -43.57 89.06 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.586 HD21 ' HG3' ' A' ' 103' ' ' MET . 24.8 tp -68.49 -50.49 51.94 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.65 -0.656 . . . . 0.0 110.087 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -57.72 -46.38 84.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.052 -1.03 . . . . 0.0 109.167 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.21 96.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.405 -0.81 . . . . 0.0 109.941 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.463 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.0 -34.92 77.43 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.535 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -65.12 -48.13 84.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.72 -37.57 84.68 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.952 -1.092 . . . . 0.0 108.256 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.41 -33.0 86.07 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.6 p-10 -93.11 -31.77 14.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.797 -1.413 . . . . 0.0 110.267 -179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.6 mtp180 -64.82 143.35 58.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.761 -1.212 . . . . 0.0 109.521 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.507 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.0 mpt_? -65.16 151.16 46.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 0.0 109.922 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -84.54 96.26 9.09 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.346 -0.847 . . . . 0.0 108.952 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.899 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.427 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.425 -1.918 0 O4'-C1'-C2' 108.187 1.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.475 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-C2' 108.638 2.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.735 0 O4'-C4'-C3' 107.573 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.084 0 O5'-C5'-C4' 113.25 2.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.798 0 O5'-C5'-C4' 113.048 2.034 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.902 0 O5'-C5'-C4' 113.132 2.095 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O4'-C4'-C3' 107.41 1.81 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.588 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.15 0 O4'-C4'-C3' 107.848 2.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.007 0 O5'-C5'-C4' 113.143 2.102 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C4'-C3' 107.866 2.266 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.834 0 O5'-C5'-C4' 113.191 2.136 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.94 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.042 0 O4'-C4'-C3' 107.777 2.177 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.898 0 O4'-C4'-C3' 107.683 2.083 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.167 0 O4'-C4'-C3' 107.97 2.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.899 ' H6 ' HO5' ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O4'-C1'-C2' 108.976 2.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.185 0 C4'-C3'-C2' 105.725 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O5'-C5'-C4' 112.839 1.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.522 0 O5'-C5'-C4' 113.803 2.574 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.448 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.427 -1.715 0 O4'-C4'-C3' 107.744 2.144 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.589 ' C7 ' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.529 2.246 0 O4'-C4'-C3' 107.943 2.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.721 0 O5'-C5'-C4' 113.374 2.267 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.539 0 O5'-C5'-C4' 113.465 2.332 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C1'-C2' 108.671 2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.107 0 O4'-C4'-C3' 107.977 2.377 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.153 0 O4'-C4'-C3' 107.484 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.378 0 O4'-C4'-C3' 107.79 2.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C4'-C3' 107.66 2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.027 0 O4'-C4'-C3' 107.815 2.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 O4'-C4'-C3' 107.599 1.999 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 44.2 p90 -70.21 150.19 46.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.212 -1.17 . . . . 0.0 109.956 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.71 137.67 32.17 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.385 -0.822 . . . . 0.0 109.833 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -55.81 -36.65 67.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.56 -0.712 . . . . 0.0 110.108 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -62.91 -42.98 99.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.866 -1.147 . . . . 0.0 109.01 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -55.56 -41.43 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.239 -0.913 . . . . 0.0 109.054 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.785 ' O ' HG13 ' A' ' 13' ' ' VAL . 24.9 mm-40 -71.7 -37.23 70.71 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.359 -0.838 . . . . 0.0 109.037 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.34 -51.31 70.36 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.175 -0.953 . . . . 0.0 109.388 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -63.29 -44.37 95.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.164 -0.96 . . . . 0.0 109.432 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -66.05 -48.54 70.71 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.881 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.785 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.3 m -69.5 -36.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.727 -1.233 . . . . 0.0 108.603 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -56.7 -39.4 73.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.495 -1.378 . . . . 0.0 107.863 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.8 mm-40 -58.34 -32.08 68.18 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.456 ' CD1' HD13 ' A' ' 46' ' ' LEU . 8.8 mt -71.35 -40.29 70.78 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.0 111.934 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -75.5 -32.92 60.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.452 -1.405 . . . . 0.0 110.119 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.466 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.4 mt-10 -67.08 -26.15 66.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.995 -1.066 . . . . 0.0 110.48 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.525 HD13 HH21 ' A' ' 25' ' ' ARG . 34.4 mt -38.36 -41.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 121.566 -0.708 . . . . 0.0 110.502 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.443 ' C ' ' OD1' ' A' ' 20' ' ' ASN . 36.5 p30 -172.71 165.65 5.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.873 -1.142 . . . . 0.0 110.309 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -91.1 69.52 6.2 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.663 -0.648 . . . . 0.0 109.63 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -112.19 103.87 55.62 Favored Pre-proline 0 N--CA 1.493 1.695 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -48.62 -42.92 35.19 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.066 1.844 . . . . 0.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -62.54 -38.03 88.44 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.276 -0.89 . . . . 0.0 108.805 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.664 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -60.54 -44.96 95.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.481 -0.762 . . . . 0.0 109.874 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.31 -53.87 48.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.226 -0.921 . . . . 0.0 109.729 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -51.77 -39.76 59.13 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.32 -60.5 3.31 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.425 -0.797 . . . . 0.0 109.933 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' NH1' ' A' ' 25' ' ' ARG . 72.7 mt -54.75 -46.91 74.38 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 109.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.519 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 93.6 m-20 -63.03 -47.34 83.47 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.458 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -67.09 -43.33 82.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.181 -0.949 . . . . 0.0 109.325 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.25 -51.51 69.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.342 -0.849 . . . . 0.0 110.345 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.02 -35.29 74.75 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 117.75 -1.58 . . . . 0.0 107.715 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -69.74 -51.48 33.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.596 -0.69 . . . . 0.0 110.599 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -59.55 -43.92 93.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.245 -0.91 . . . . 0.0 111.92 -178.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.0 mtp -57.38 -31.33 65.69 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 111.268 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -54.13 -40.37 67.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.493 -1.38 . . . . 0.0 108.553 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -65.99 -40.19 90.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.449 -0.782 . . . . 0.0 109.186 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -63.76 -30.69 71.76 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.632 -0.667 . . . . 0.0 110.194 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.57 1.55 68.43 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 107.914 -2.075 . . . . 0.0 107.914 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.1 p -118.8 84.45 25.42 Favored Pre-proline 0 N--CA 1.487 1.411 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.9 146.08 10.23 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.622 2.214 . . . . 0.0 111.397 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 11.7 mt -79.44 95.22 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 119.126 -1.03 . . . . 0.0 109.454 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.59 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 77.5 m-20 -64.4 -43.55 94.09 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -136.42 133.38 36.61 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.456 HD13 ' CD1' ' A' ' 16' ' ' LEU . 7.3 mt -69.98 132.49 88.49 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 120.777 -1.202 . . . . 0.0 108.714 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -58.99 140.11 93.87 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 N-CA-C 108.82 -1.262 . . . . 0.0 108.82 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.565 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 10.9 mt -106.22 146.02 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.954 -1.091 . . . . 0.0 110.839 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.852 ' SD ' HD13 ' A' ' 54' ' ' LEU . 82.6 mtp -143.54 121.11 11.76 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.18 39.45 1.71 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -178.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt 56.78 22.2 6.73 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.547 0.689 . . . . 0.0 109.576 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.1 m -132.19 150.52 52.14 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -67.65 146.72 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.832 -1.168 . . . . 0.0 108.966 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.852 HD13 ' SD ' ' A' ' 49' ' ' MET . 44.0 tp -74.6 118.06 17.14 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 109.778 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -62.27 93.26 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.327 -0.858 . . . . 0.0 108.95 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -54.09 -26.99 29.98 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.054 -1.029 . . . . 0.0 109.405 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -78.88 -59.34 2.82 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.118 -0.988 . . . . 0.0 111.666 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -57.41 -37.6 73.01 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.502 -1.374 . . . . 0.0 109.519 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.684 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.21 -46.66 87.87 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.479 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 46.2 t80 -61.28 -70.64 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.387 0.613 . . . . 0.0 109.551 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 60' ' ' TYR . 54.3 t30 -38.26 -40.83 0.56 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.657 -0.652 . . . . 0.0 111.01 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.569 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 52.0 mt -72.44 -46.67 53.98 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.356 -1.338 . . . . 0.0 108.277 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 18.9 t -56.37 -43.53 77.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.214 -0.929 . . . . 0.0 110.491 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.479 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.8 mm -70.42 -35.22 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.712 -1.243 . . . . 0.0 108.11 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.68 -19.68 17.7 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.765 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.638 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.3 mmt-85 -94.1 -0.38 55.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.735 -1.228 . . . . 0.0 108.234 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 14.13 80.16 Favored Glycine 0 N--CA 1.492 2.414 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.609 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.47 ' HA2' HD13 ' A' ' 116' ' ' LEU . . . 147.3 126.21 1.66 Allowed Glycine 0 N--CA 1.5 2.935 0 O-C-N 120.065 -1.844 . . . . 0.0 111.582 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.588 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.6 tp -47.33 -41.01 18.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.492 -1.005 . . . . 0.0 109.956 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.3 t -61.42 -42.19 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.031 -1.043 . . . . 0.0 110.197 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -54.98 -37.53 66.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 108.749 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.1 t -65.91 -43.07 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.521 -0.737 . . . . 0.0 110.502 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.9 mt -66.89 -58.65 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.701 -1.249 . . . . 0.0 110.239 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.459 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 96.3 m-20 -58.64 -40.75 84.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.157 -0.964 . . . . 0.0 110.544 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.4 mmtp -92.64 -10.2 38.21 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.157 -0.964 . . . . 0.0 110.614 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 72' ' ' VAL . 49.5 mttp 58.69 56.96 3.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.519 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.46 15.72 10.2 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.837 -1.164 . . . . 0.0 108.12 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.52 ' NE1' HG12 ' A' ' 72' ' ' VAL . 92.9 m95 -65.14 -40.82 94.95 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' NE2' ' OP2' ' C' ' 419' ' ' ' DC' . 97.0 mm-40 -49.06 -38.43 24.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.192 -1.403 . . . . 0.0 107.995 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.638 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.0 mt-10 -69.14 -40.86 77.98 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.498 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.9 mt -71.67 -52.48 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.637 HD11 ' HB2' ' A' ' 95' ' ' ALA . 83.8 mt -51.85 -53.75 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.633 -0.667 . . . . 0.0 110.115 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 79' ' ' GLN . 59.9 mttp -70.88 -37.56 73.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.77 -1.206 . . . . 0.0 110.019 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -54.96 -33.7 57.18 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.264 -1.535 . . . . 0.0 109.264 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.2 mt -86.7 -10.54 53.48 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.4 -1.059 . . . . 0.0 108.566 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 67.78 40.66 2.37 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.34 0.59 . . . . 0.0 110.513 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.72 141.55 79.31 Favored Pre-proline 0 N--CA 1.487 1.405 0 O-C-N 121.157 -0.964 . . . . 0.0 108.634 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.559 ' C ' ' H ' ' A' ' 90' ' ' SER . 39.8 Cg_endo -71.59 142.03 39.31 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 121.979 1.786 . . . . 0.0 112.076 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.0 p -55.73 0.01 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.559 ' H ' ' C ' ' A' ' 88' ' ' PRO . 20.4 m -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.077 -1.015 . . . . 0.0 109.937 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.3 mt -92.86 101.57 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 120.781 -1.199 . . . . 0.0 109.258 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -71.26 -29.53 65.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.226 -0.921 . . . . 0.0 109.179 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.407 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 50.3 m -96.32 40.07 1.14 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.46 -0.775 . . . . 0.0 109.472 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -62.6 1.51 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.945 . . . . 0.0 108.721 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.637 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.6 -51.06 22.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.289 -0.882 . . . . 0.0 109.694 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.531 HD22 ' C7 ' ' C' ' 421' ' ' ' DT' . 7.1 tp -58.53 -41.22 85.0 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.603 -1.31 . . . . 0.0 108.61 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.623 HG22 HE22 ' A' ' 101' ' ' GLN . 35.8 m -63.87 -41.31 97.78 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.272 -0.893 . . . . 0.0 109.271 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.423 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -68.49 -46.35 69.92 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.266 -0.896 . . . . 0.0 110.692 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.752 ' NH1' HD21 ' A' ' 129' ' ' ASN . 34.6 ttp180 -68.17 -48.57 64.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.137 -0.977 . . . . 0.0 110.833 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.9 m -55.54 -53.54 55.13 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.058 -1.026 . . . . 0.0 110.017 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.623 HE22 HG22 ' A' ' 97' ' ' THR . 8.4 mt-30 -64.68 -41.19 96.23 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.954 -1.091 . . . . 0.0 111.548 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.3 t80 -57.23 -41.98 80.56 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 120.317 -1.489 . . . . 0.0 109.007 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.697 ' HG2' HD21 ' A' ' 122' ' ' LEU . 83.1 mtp -54.24 -57.69 10.23 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-O 121.471 0.653 . . . . 0.0 112.246 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -71.17 -51.47 24.67 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.414 -1.429 . . . . 0.0 112.099 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' HD12 ' A' ' 106' ' ' LEU . 60.6 m-85 -84.67 -46.14 11.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -175.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.9 mp -103.13 11.97 36.41 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.355 -1.466 . . . . 0.0 113.835 -176.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.541 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.5 t80 -68.79 -38.4 11.65 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 119.903 -1.748 . . . . 0.0 111.492 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 86.9 Cg_endo -79.1 -41.57 0.22 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.535 1.49 . . . . 0.0 112.514 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -58.47 -41.92 86.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.856 -1.152 . . . . 0.0 107.975 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.492 ' CG ' HD12 ' A' ' 116' ' ' LEU . 61.3 tt0 -70.65 -49.58 45.9 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.443 0.64 . . . . 0.0 110.213 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.516 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.5 t -74.82 -44.43 49.33 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.379 -0.826 . . . . 0.0 110.675 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.0 tp10 -66.4 -46.05 77.93 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.347 -0.846 . . . . 0.0 111.061 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -75.08 -33.2 61.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.039 -1.038 . . . . 0.0 111.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.02 -25.18 3.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.844 -1.16 . . . . 0.0 112.133 -177.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.0 t-20 59.26 50.7 7.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.579 -1.326 . . . . 0.0 110.506 178.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.492 HD12 ' CG ' ' A' ' 110' ' ' GLU . 26.2 mt -68.37 -32.17 72.06 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.346 -0.847 . . . . 0.0 111.839 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 10.0 t -154.66 -167.02 2.48 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 118.465 -1.294 . . . . 0.0 111.502 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.7 p -123.77 160.3 52.02 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 121.771 -0.58 . . . . 0.0 109.574 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -59.98 -38.69 76.75 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.348 1.365 . . . . 0.0 112.007 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.56 86.71 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.987 -1.071 . . . . 0.0 109.561 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.25 -48.37 67.95 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.697 HD21 ' HG2' ' A' ' 103' ' ' MET . 39.8 tp -63.22 -53.2 56.85 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.486 -0.759 . . . . 0.0 109.92 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -57.76 -44.33 86.09 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.002 -1.061 . . . . 0.0 109.235 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.18 91.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.738 . . . . 0.0 111.074 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.459 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -69.2 -32.08 71.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.027 -1.046 . . . . 0.0 109.17 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.684 ' CG2' ' NH2' ' A' ' 130' ' ' ARG . 12.0 mt -63.58 -49.42 82.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.001 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.17 -35.93 78.82 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.45 -17.9 67.04 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.752 HD21 ' NH1' ' A' ' 99' ' ' ARG . 17.2 p-10 -94.3 -30.58 14.46 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.842 -1.387 . . . . 0.0 110.644 -179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.684 ' NH2' ' CG2' ' A' ' 126' ' ' ILE . 1.1 mtt-85 -61.73 145.82 51.23 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.65 -1.281 . . . . 0.0 110.112 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.543 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.7 mpt_? -69.41 149.13 48.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.526 -0.734 . . . . 0.0 109.299 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.39 1.39 16.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.161 -0.962 . . . . 0.0 110.132 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.408 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.426 -1.812 0 O4'-C1'-C2' 107.865 1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.587 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 1.983 0 O4'-C1'-C2' 108.737 2.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.951 0 O4'-C4'-C3' 107.554 1.954 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O5'-C5'-C4' 113.318 2.227 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O5'-C5'-C4' 113.297 2.212 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.77 0 O5'-C5'-C4' 113.043 2.03 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.755 0 O4'-C4'-C3' 107.367 1.767 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.565 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.181 0 O4'-C4'-C3' 107.849 2.249 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . 0.5 ' C5 ' ' N6 ' ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.003 0 O5'-C5'-C4' 113.01 2.007 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.5 ' N6 ' ' C5 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.327 0 O4'-C4'-C3' 107.985 2.385 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.872 0 O5'-C5'-C4' 113.055 2.039 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O5'-C5'-C4' 113.475 2.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.798 0 O4'-C4'-C3' 107.978 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.857 0 O4'-C4'-C3' 107.398 1.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.224 0 O4'-C4'-C3' 107.893 2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.47 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.261 0 O4'-C1'-C2' 107.71 1.463 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.47 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C4'-C3' 107.954 2.354 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.465 ' C2 ' ' C2 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.668 0 O4'-C4'-C3' 107.2 1.6 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.465 ' C2 ' ' C2 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.606 1.302 0 O5'-C5'-C4' 113.7 2.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.58 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.427 -1.716 0 O4'-C4'-C3' 107.786 2.186 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.531 ' C7 ' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 P--O5' 1.61 1.718 0 O4'-C4'-C3' 107.789 2.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.576 0 O5'-C5'-C4' 113.045 2.032 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.005 0 O5'-C5'-C4' 113.365 2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.988 0 C4'-C3'-C2' 105.628 2.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.841 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C4'-C3' 107.629 2.029 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.159 0 O4'-C4'-C3' 107.922 2.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.73 0 O4'-C4'-C3' 107.733 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C4'-C3' 107.912 2.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C4'-C3' 107.601 2.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.335 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -114.23 75.88 0.95 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 109.525 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.4 p -114.2 145.53 41.57 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.263 -0.898 . . . . 0.0 109.65 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -54.85 -38.27 67.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.456 -0.777 . . . . 0.0 110.219 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.5 -45.69 91.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.794 -1.191 . . . . 0.0 109.643 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.26 -40.87 91.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 109.619 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.969 ' O ' HG12 ' A' ' 13' ' ' VAL . 4.9 mm100 -68.91 -42.73 76.44 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.432 -0.792 . . . . 0.0 110.046 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.02 -46.67 84.91 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.291 -0.881 . . . . 0.0 109.826 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -62.27 -43.69 98.25 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.009 -1.057 . . . . 0.0 109.54 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -65.91 -50.21 65.25 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.457 -0.777 . . . . 0.0 111.09 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.969 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.2 p -68.15 -39.02 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.705 -1.247 . . . . 0.0 109.455 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.52 -38.35 87.06 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.274 -1.516 . . . . 0.0 107.757 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -56.22 -32.41 64.42 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.085 -1.046 . . . . 0.0 108.179 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.483 ' HB3' HD13 ' A' ' 29' ' ' LEU . 6.5 mt -66.85 -41.2 87.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.316 -0.865 . . . . 0.0 111.734 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -75.7 -36.59 59.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.363 -1.461 . . . . 0.0 109.88 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -70.3 -3.86 19.27 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.072 -1.018 . . . . 0.0 110.97 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.652 HG21 ' NH1' ' A' ' 25' ' ' ARG . 8.9 mt -56.66 -41.42 74.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 O-C-N 121.236 -0.915 . . . . 0.0 109.467 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -171.85 166.41 6.43 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.058 -1.026 . . . . 0.0 110.397 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.496 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.9 p30 -89.22 67.27 7.86 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.641 -0.662 . . . . 0.0 110.835 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' C ' ' OD1' ' A' ' 22' ' ' ASP . 8.8 t0 -112.17 95.41 30.15 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.12 -41.65 33.65 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 122.207 1.938 . . . . 0.0 112.794 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -62.56 -40.03 95.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.908 -1.12 . . . . 0.0 108.752 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.652 ' NH1' HG21 ' A' ' 19' ' ' ILE . 63.1 ttt180 -59.69 -36.12 75.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 110.11 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -60.15 -52.94 63.17 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.403 -0.811 . . . . 0.0 109.354 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -52.65 -38.3 60.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.471 -0.768 . . . . 0.0 109.971 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -64.48 -59.74 3.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.081 -1.012 . . . . 0.0 110.81 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.483 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.7 mt -52.93 -47.91 67.7 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.041 -1.037 . . . . 0.0 108.791 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -61.93 -45.14 95.01 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.418 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.1 -46.73 73.33 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.218 -0.926 . . . . 0.0 109.843 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.5 tp -57.21 -47.78 80.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.224 -0.922 . . . . 0.0 110.276 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CE2' HG23 ' A' ' 13' ' ' VAL . 47.7 m-85 -61.89 -36.6 81.78 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.19 -1.404 . . . . 0.0 107.679 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -70.24 -53.12 18.31 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.564 -0.71 . . . . 0.0 109.975 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 74.6 t80 -59.2 -42.08 90.06 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.375 -0.828 . . . . 0.0 111.172 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mmm -57.23 -34.85 68.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.944 . . . . 0.0 110.443 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -54.63 -39.92 68.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 109.362 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -74.89 -30.21 61.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 108.793 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 14.6 mmm180 -65.72 -30.85 71.58 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.742 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.93 -0.63 69.78 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.5 p -116.68 84.48 15.4 Favored Pre-proline 0 N--CA 1.488 1.468 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -83.14 139.03 9.25 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 122.558 2.172 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.9 mt -73.75 96.76 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.091 -1.005 . . . . 0.0 110.246 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.433 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 81.9 m-20 -60.52 -33.99 73.44 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -158.98 139.24 12.24 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.462 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.92 125.37 92.0 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.032 -1.043 . . . . 0.0 110.157 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -53.21 139.52 62.99 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.576 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 8.7 mt -103.11 146.7 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.867 -1.146 . . . . 0.0 110.714 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 73.2 mmm -137.41 127.06 25.27 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 56.85 42.89 25.83 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.93 24.51 12.64 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.365 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -135.05 153.84 51.92 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.182 -0.949 . . . . 0.0 109.324 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.2 m -67.27 142.09 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 120.983 -1.073 . . . . 0.0 109.387 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 HD22 ' A' ' 59' ' ' LEU . 64.8 tp -75.16 123.48 25.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.307 -0.871 . . . . 0.0 110.012 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.595 ' CG ' HH22 ' A' ' 25' ' ' ARG . 38.5 m-20 -59.56 99.96 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.521 -0.737 . . . . 0.0 109.719 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.6 -30.32 71.25 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.074 -1.016 . . . . 0.0 109.234 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -80.85 -60.56 2.26 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.291 -0.881 . . . . 0.0 111.578 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -54.1 -38.16 65.07 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.666 -1.271 . . . . 0.0 108.584 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.639 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.95 -46.37 89.64 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.441 ' CE2' HG13 ' A' ' 64' ' ' ILE . 54.0 t80 -59.37 -66.38 0.52 Allowed 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 121.485 0.659 . . . . 0.0 109.731 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -42.92 -42.11 3.59 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.582 -0.699 . . . . 0.0 111.552 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.99 -43.63 64.78 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.059 -1.456 . . . . 0.0 108.066 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 36.1 t -58.98 -44.35 90.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.239 -0.913 . . . . 0.0 109.334 179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.441 HG13 ' CE2' ' A' ' 60' ' ' TYR . 15.7 mm -69.55 -38.72 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 120.738 -1.226 . . . . 0.0 108.403 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.89 -19.93 7.7 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.812 -0.555 . . . . 0.0 110.13 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.553 ' CG ' HD13 ' A' ' 77' ' ' LEU . 7.0 mpt_? -95.06 -0.82 53.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.584 -1.323 . . . . 0.0 108.957 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.63 72.56 Favored Glycine 0 N--CA 1.492 2.404 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.263 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.1 131.52 2.46 Favored Glycine 0 N--CA 1.498 2.806 0 CA-C-N 119.722 1.761 . . . . 0.0 111.703 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.485 HD11 ' CH2' ' A' ' 78' ' ' TRP . 20.1 tp -52.64 -38.97 61.27 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.678 -0.895 . . . . 0.0 109.738 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 77.8 t -56.15 -43.64 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.202 -0.936 . . . . 0.0 108.97 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -59.15 -40.2 84.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.166 -0.959 . . . . 0.0 110.025 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.595 ' O ' ' N ' ' A' ' 76' ' ' LYS . 60.5 t -63.64 -43.99 98.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 120.741 -1.224 . . . . 0.0 109.551 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 33.7 mt -65.04 -61.53 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 120.758 -1.214 . . . . 0.0 110.182 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -58.48 -41.38 85.17 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.156 -0.965 . . . . 0.0 110.764 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -10.03 44.13 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.95 -1.093 . . . . 0.0 110.261 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' VAL . 21.4 mtmm 58.69 60.66 2.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.29 -0.881 . . . . 0.0 110.951 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.553 HD13 ' CG ' ' A' ' 66' ' ' ARG . 13.0 mt -95.42 14.22 23.32 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.104 -0.998 . . . . 0.0 108.55 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' A' ' 82' ' ' ILE . 98.8 m95 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.36 -0.837 . . . . 0.0 109.03 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.445 ' C ' ' O ' ' A' ' 78' ' ' TRP . 28.6 mt-30 -48.13 -38.83 18.77 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.537 -1.352 . . . . 0.0 108.437 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.8 mm-40 -67.85 -38.61 83.35 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 178.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.3 mt -74.25 -51.41 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.68 HD11 ' HB2' ' A' ' 95' ' ' ALA . 57.3 mt -52.0 -56.05 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.49 -37.07 68.53 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.374 -0.829 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -51.85 -34.7 37.96 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.49 -4.92 55.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.373 -1.075 . . . . 0.0 109.039 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 65.72 38.98 5.01 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.642 0.734 . . . . 0.0 109.16 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.24 145.75 86.03 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.411 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.0 Cg_endo -71.06 136.68 30.11 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.281 1.987 . . . . 0.0 112.415 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 t -62.79 -0.7 0.7 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 88' ' ' PRO . 77.9 p -64.64 -25.56 68.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.987 -1.07 . . . . 0.0 109.551 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.25 99.5 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.99 -1.069 . . . . 0.0 108.748 178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 40.8 p -68.35 -31.12 70.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.108 -0.995 . . . . 0.0 108.851 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.472 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 58.4 m -88.07 29.25 0.96 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.23 -67.35 0.38 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.4 -0.813 . . . . 0.0 108.976 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.03 -47.54 33.51 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.644 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.477 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 5.5 tp -59.8 -45.53 92.06 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.33 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 36.2 m -61.63 -39.75 92.41 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.02 -1.05 . . . . 0.0 108.616 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.8 mt -70.9 -43.99 67.19 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.509 -0.745 . . . . 0.0 109.725 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.455 HH21 HD22 ' A' ' 129' ' ' ASN . 3.6 tmm_? -66.24 -51.28 59.09 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.111 -0.993 . . . . 0.0 110.66 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.2 m -57.11 -54.69 43.91 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.552 -0.718 . . . . 0.0 110.996 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -62.61 -41.2 98.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.986 -1.071 . . . . 0.0 111.393 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.9 t80 -57.32 -41.63 80.29 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.545 -1.347 . . . . 0.0 109.344 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.712 ' CE ' HD11 ' A' ' 126' ' ' ILE . 35.3 ttm -53.81 -52.89 58.88 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.823 -0.548 . . . . 0.0 111.313 -178.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -71.17 -54.84 9.62 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.811 -1.181 . . . . 0.0 112.732 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.467 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -84.86 -45.8 11.94 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -174.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.646 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.4 mp -97.4 -7.74 31.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.121 -1.612 . . . . 0.0 114.255 -175.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.634 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 26.6 t80 -57.94 -38.3 65.2 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 119.822 -1.799 . . . . 0.0 110.006 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 24.4 Cg_exo -65.0 -54.43 0.66 Allowed 'Trans proline' 0 N--CA 1.5 1.881 0 C-N-CA 122.513 2.142 . . . . 0.0 112.793 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.23 -44.07 88.04 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.178 -0.951 . . . . 0.0 108.64 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.33 -53.95 30.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 110.502 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.634 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 58.0 m -71.62 -45.09 63.11 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -0.868 . . . . 0.0 111.456 -177.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -67.67 -49.44 62.82 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.912 -1.117 . . . . 0.0 111.268 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -76.76 -23.79 52.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.995 -1.065 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.419 ' HG2' HD21 ' A' ' 116' ' ' LEU . 15.1 tptp -125.88 -30.96 2.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.81 -1.181 . . . . 0.0 111.416 -177.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 111' ' ' CYS . 15.3 t30 56.32 47.02 19.96 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.92 -1.113 . . . . 0.0 110.226 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.419 HD21 ' HG2' ' A' ' 114' ' ' LYS . 48.5 mt -67.64 -30.28 69.8 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.003 -1.06 . . . . 0.0 111.114 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 32.1 t -153.94 -166.64 2.43 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.371 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 64.0 p -126.79 153.66 75.92 Favored Pre-proline 0 N--CA 1.497 1.903 0 O-C-N 121.711 -0.618 . . . . 0.0 109.984 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -52.08 -40.54 68.05 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.121 1.881 . . . . 0.0 112.188 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.27 89.35 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.769 -1.207 . . . . 0.0 109.727 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -65.84 -42.94 89.86 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.6 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.1 tp -65.69 -53.59 38.92 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.576 -0.702 . . . . 0.0 109.937 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.629 ' HA ' HD12 ' A' ' 126' ' ' ILE . 68.3 tp60 -56.05 -44.37 78.78 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.55 75.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.54 -36.12 73.51 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.752 0.786 . . . . 0.0 108.954 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.712 HD11 ' CE ' ' A' ' 103' ' ' MET . 34.0 mt -59.05 -52.89 55.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -67.0 -37.7 84.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.509 -0.744 . . . . 0.0 109.327 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.15 -30.11 72.89 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.539 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 7.1 p30 -95.82 -36.36 11.16 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.916 -1.344 . . . . 0.0 110.505 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.539 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 55.7 mtp180 -63.84 145.38 55.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.85 -1.156 . . . . 0.0 110.295 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.578 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -66.21 144.83 56.39 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.655 -0.653 . . . . 0.0 109.334 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -108.43 -153.6 0.51 Allowed 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.343 -0.848 . . . . 0.0 108.807 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.686 -1.365 . . . . 0.0 109.686 -179.952 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.408 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -2.002 0 O4'-C1'-C2' 108.188 1.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.557 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.927 0 O4'-C1'-C2' 108.698 2.362 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.957 0 O4'-C4'-C3' 107.631 2.031 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.487 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O5'-C5'-C4' 113.197 2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.029 0 O5'-C5'-C4' 113.126 2.09 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.887 0 O5'-C5'-C4' 112.811 1.865 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.576 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.203 0 O4'-C4'-C3' 107.75 2.15 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.981 0 O4'-C4'-C3' 107.679 2.079 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.917 0 O4'-C1'-C2' 108.705 2.368 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O5'-C5'-C4' 113.125 2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.223 0 O5'-C5'-C4' 113.468 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.689 0 O5'-C5'-C4' 113.031 2.022 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C4'-C3' 107.385 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.972 2.372 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.466 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.424 0 O4'-C1'-C2' 107.558 1.325 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.466 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C1'-C2' 108.702 2.365 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.41 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.198 0 O5'-C5'-C4' 112.576 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.41 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.629 0 C4'-C3'-C2' 105.618 2.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.42 ' OP1' ' OD1' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C4'-C3' 107.843 2.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.477 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O4'-C4'-C3' 107.725 2.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.019 0 O5'-C5'-C4' 113.438 2.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.929 0 O5'-C5'-C4' 113.386 2.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.826 0 O4'-C1'-C2' 108.777 2.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C4'-C3' 108.052 2.452 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.905 0 O4'-C4'-C3' 107.887 2.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.391 0 O4'-C4'-C3' 107.929 2.329 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.739 0 O4'-C4'-C3' 107.793 2.193 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.777 0 O4'-C4'-C3' 107.781 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C4'-C3' 107.703 2.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -113.9 78.93 1.19 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.419 -1.047 . . . . 0.0 108.71 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -109.62 140.92 42.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.534 -0.729 . . . . 0.0 109.987 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 6' ' ' PHE . 0.0 OUTLIER -57.28 -43.01 82.76 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.439 -0.788 . . . . 0.0 109.474 -179.136 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.41 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 95.1 mt-10 -63.32 -45.78 89.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.012 -1.055 . . . . 0.0 109.208 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -56.76 -39.94 74.94 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 108.615 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.888 ' O ' HG12 ' A' ' 13' ' ' VAL . 6.3 mm100 -69.14 -37.78 78.48 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.483 -0.76 . . . . 0.0 109.038 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -55.15 -49.4 71.92 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.363 -0.836 . . . . 0.0 109.62 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -61.6 -38.73 88.68 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.92 -1.113 . . . . 0.0 109.176 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -65.21 -52.56 53.94 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.482 -0.761 . . . . 0.0 111.13 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.888 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -70.53 -35.95 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.989 -1.069 . . . . 0.0 109.62 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -60.05 -38.73 83.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.305 -1.497 . . . . 0.0 107.894 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -58.93 -31.87 69.05 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.9 mt -67.44 -36.41 81.16 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.436 -0.79 . . . . 0.0 110.964 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.417 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 81.5 m-85 -82.32 -38.62 24.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.375 -1.453 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.6 -30.25 71.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.067 -1.021 . . . . 0.0 111.032 -177.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 16' ' ' LEU . 8.1 mt -38.02 -37.08 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 O-C-N 121.567 -0.708 . . . . 0.0 110.363 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.3 m120 -170.31 159.68 7.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.952 -1.093 . . . . 0.0 109.78 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.2 64.82 4.56 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.736 -0.603 . . . . 0.0 109.525 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.94 137.55 20.15 Favored Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -71.81 -61.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.029 1.819 . . . . 0.0 112.198 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -59.35 -37.84 78.89 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.224 -0.923 . . . . 0.0 109.649 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.482 ' NH2' HG21 ' A' ' 19' ' ' ILE . 57.0 ttt180 -56.84 -42.39 79.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.646 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -60.9 -54.23 47.65 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.154 -0.966 . . . . 0.0 108.834 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -53.42 -36.17 61.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.591 -0.693 . . . . 0.0 109.633 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -61.42 -62.91 1.49 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.344 -0.847 . . . . 0.0 110.816 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.632 HD22 HD13 ' A' ' 16' ' ' LEU . 16.4 mt -57.13 -44.45 83.36 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.515 -0.741 . . . . 0.0 109.55 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.417 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 30.6 m-20 -63.4 -45.9 88.9 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.352 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -66.43 -42.37 87.82 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.114 -0.991 . . . . 0.0 109.008 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.97 -50.51 73.15 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.322 -0.861 . . . . 0.0 110.169 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -60.83 -34.08 74.01 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 117.988 -1.485 . . . . 0.0 107.971 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.5 m -68.88 -50.16 52.06 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.092 -1.005 . . . . 0.0 108.942 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.1 -43.27 95.7 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 111.103 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.7 mmm -58.22 -35.79 72.18 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.229 -0.92 . . . . 0.0 110.84 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -59.19 -40.33 85.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.695 -1.253 . . . . 0.0 108.853 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -64.73 -40.91 96.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.332 -0.855 . . . . 0.0 109.396 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -65.2 -30.11 70.98 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.898 -0.501 . . . . 0.0 110.412 -178.758 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 1.13 64.63 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 107.775 -2.13 . . . . 0.0 107.775 -178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.4 p -116.56 85.23 16.22 Favored Pre-proline 0 N--CA 1.488 1.434 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -83.53 148.47 12.72 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.733 2.289 . . . . 0.0 111.716 -179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.622 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 46.0 mt -87.52 101.42 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.037 -1.039 . . . . 0.0 110.195 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.41 ' C ' ' OE1' ' A' ' 9' ' ' GLN . 84.9 m-20 -85.95 -0.77 56.31 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.311 -0.868 . . . . 0.0 109.026 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.6 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -171.79 120.23 0.46 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.507 -0.745 . . . . 0.0 109.206 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.53 HD23 HG21 ' A' ' 43' ' ' ILE . 14.0 mt -72.09 118.9 71.21 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.054 -1.029 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.438 ' HB3' ' NE2' ' A' ' 101' ' ' GLN . 48.3 Cg_exo -49.72 128.29 20.94 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 N-CA-C 108.831 -1.257 . . . . 0.0 108.831 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.608 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 60.4 mt -95.71 144.19 10.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.134 -0.979 . . . . 0.0 110.608 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.71 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.4 mtp -135.09 122.1 21.26 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.87 39.83 3.27 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -178.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 58.6 24.4 12.0 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.252 0.549 . . . . 0.0 110.247 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.502 ' N ' HG23 ' A' ' 48' ' ' ILE . 78.2 p -136.64 152.75 50.77 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.189 -0.945 . . . . 0.0 109.445 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.9 m -67.39 144.99 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 120.973 -1.079 . . . . 0.0 109.216 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.71 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.3 tp -74.16 120.49 19.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 110.028 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -63.05 91.8 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.341 -0.85 . . . . 0.0 109.09 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.06 -26.22 59.99 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.145 -0.972 . . . . 0.0 110.096 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.444 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 44.3 t80 -81.02 -57.03 3.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.066 -1.021 . . . . 0.0 111.586 -178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.43 -37.87 79.21 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.564 -1.335 . . . . 0.0 109.411 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.629 HD22 HD21 ' A' ' 54' ' ' LEU . 65.3 tp -59.83 -45.99 90.65 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CE2' HG13 ' A' ' 64' ' ' ILE . 43.3 t80 -57.26 -66.64 0.42 Allowed 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.522 0.677 . . . . 0.0 109.41 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 74.6 m-20 -41.43 -41.13 1.94 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.689 -0.632 . . . . 0.0 111.219 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.44 -43.14 64.2 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 118.234 -1.386 . . . . 0.0 107.689 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 43.7 t -59.39 -44.75 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.874 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.413 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -69.51 -36.86 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.663 -1.273 . . . . 0.0 108.318 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.403 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.1 -22.81 11.88 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.848 -0.533 . . . . 0.0 110.27 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.517 ' CG ' HD13 ' A' ' 77' ' ' LEU . 9.0 mpt_? -92.93 -0.22 57.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.614 -1.304 . . . . 0.0 108.753 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.98 17.99 68.55 Favored Glycine 0 N--CA 1.49 2.252 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.818 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 141.24 129.38 2.48 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 120.548 -1.56 . . . . 0.0 111.259 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.55 HD11 ' CH2' ' A' ' 78' ' ' TRP . 15.6 tp -50.36 -40.64 49.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.677 -0.896 . . . . 0.0 110.361 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.2 t -57.75 -42.14 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.861 -1.149 . . . . 0.0 109.871 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -55.94 -40.12 72.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.914 -1.116 . . . . 0.0 108.909 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 94.0 t -65.06 -41.29 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 110.157 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.47 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 49.3 mt -67.59 -56.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 O-C-N 120.775 -1.203 . . . . 0.0 109.734 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -57.69 -42.03 82.84 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.136 -0.977 . . . . 0.0 110.184 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -92.23 -10.21 39.38 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.253 -0.904 . . . . 0.0 110.452 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 3.5 mtmp? 58.54 59.08 3.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.385 -0.822 . . . . 0.0 110.05 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 15.37 11.46 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.014 -1.054 . . . . 0.0 108.545 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.734 ' HE1' HH12 ' A' ' 99' ' ' ARG . 99.0 m95 -63.26 -37.56 87.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 108.923 178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.419 ' C ' ' O ' ' A' ' 78' ' ' TRP . 1.1 mp0 -48.9 -40.82 31.35 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.439 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HB3' HH21 ' A' ' 66' ' ' ARG . 81.3 mm-40 -69.05 -38.85 79.34 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt -71.28 -53.46 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.718 HD11 ' HB2' ' A' ' 95' ' ' ALA . 76.3 mt -53.19 -52.83 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -73.58 -40.29 64.0 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.292 -0.88 . . . . 0.0 109.889 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.05 -34.18 46.06 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 87.7 mt -88.48 -7.2 56.94 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.287 -1.125 . . . . 0.0 108.886 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 7.2 m80 69.15 36.67 2.34 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.576 0.703 . . . . 0.0 109.245 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -73.3 121.01 84.06 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.359 -0.838 . . . . 0.0 109.198 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 90' ' ' SER . 45.9 Cg_exo -50.08 139.62 34.06 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.669 1.579 . . . . 0.0 112.23 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 p -63.44 0.87 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 109.619 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 88' ' ' PRO . 89.1 p -65.04 -24.49 67.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.935 -178.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 50' ' ' ALA . 86.6 mt -95.72 98.43 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.948 -1.095 . . . . 0.0 108.894 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 30.6 p -68.36 -28.51 67.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -0.92 . . . . 0.0 108.803 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.8 m -90.5 30.54 1.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.26 -65.9 0.62 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.855 . . . . 0.0 108.986 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.718 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.92 -50.7 33.95 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 109.179 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.03 -45.66 86.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.851 -1.156 . . . . 0.0 108.978 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.9 m -60.67 -40.02 90.56 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.174 -0.954 . . . . 0.0 108.845 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.5 mt -72.56 -44.49 62.02 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.452 -0.78 . . . . 0.0 110.152 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.734 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.6 ttm-85 -65.99 -52.86 45.65 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.176 -0.953 . . . . 0.0 110.739 -179.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.1 m -57.05 -52.73 64.11 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.43 -0.794 . . . . 0.0 110.778 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.438 ' NE2' ' HB3' ' A' ' 47' ' ' PRO . 86.6 mt-30 -62.34 -40.67 97.13 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.127 -0.983 . . . . 0.0 111.142 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.4 t80 -57.92 -39.49 78.1 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 120.55 -1.344 . . . . 0.0 109.038 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.538 ' HG3' HD21 ' A' ' 122' ' ' LEU . 2.9 ttm -53.96 -56.49 17.34 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.548 -0.72 . . . . 0.0 111.877 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -72.42 -52.18 17.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.479 -1.388 . . . . 0.0 113.032 -176.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.428 ' C ' HD12 ' A' ' 106' ' ' LEU . 62.6 m-85 -85.33 -50.96 6.9 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.629 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -96.52 6.05 49.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.338 -1.476 . . . . 0.0 113.751 -176.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.598 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 78.0 t80 -68.42 -37.15 9.83 Favored Pre-proline 0 C--N 1.3 -1.545 0 O-C-N 120.013 -1.68 . . . . 0.0 111.666 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.1 Cg_endo -80.28 -39.52 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.333 1.356 . . . . 0.0 111.688 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.47 -39.84 84.99 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -72.68 -53.91 10.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.482 -0.761 . . . . 0.0 109.909 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.59 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.8 t -70.56 -44.25 67.81 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.294 -0.879 . . . . 0.0 110.739 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.447 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 43.3 tp10 -66.79 -47.87 70.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 120.759 -1.213 . . . . 0.0 110.851 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -75.97 -28.17 57.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 111.158 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HG2' HD21 ' A' ' 116' ' ' LEU . 44.3 tptt -125.32 -26.55 3.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.064 -1.022 . . . . 0.0 111.811 -177.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 111' ' ' CYS . 48.3 t-20 57.72 45.67 18.5 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.644 -1.285 . . . . 0.0 110.048 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.462 HD21 ' HG2' ' A' ' 114' ' ' LYS . 75.6 mt -68.4 -32.61 72.79 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.203 -0.935 . . . . 0.0 110.958 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.505 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 42.9 t -155.79 -166.93 2.34 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.633 -1.227 . . . . 0.0 111.94 -178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.456 ' C ' ' OH ' ' A' ' 107' ' ' TYR . 70.5 p -120.55 153.65 56.53 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -179.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.598 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 14.7 Cg_endo -59.35 -38.17 86.09 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.876 1.717 . . . . 0.0 112.186 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.07 85.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.051 -1.031 . . . . 0.0 109.319 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.505 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.9 mt-10 -66.81 -42.73 85.4 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.538 HD21 ' HG3' ' A' ' 103' ' ' MET . 11.5 tp -64.74 -52.85 54.87 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 109.431 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -57.89 -46.43 84.92 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.201 -0.937 . . . . 0.0 109.065 178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.8 -42.72 98.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.38 -0.825 . . . . 0.0 110.152 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.53 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.061 -1.024 . . . . 0.0 108.342 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.523 ' HA ' ' ND2' ' A' ' 129' ' ' ASN . 4.1 mt -65.47 -49.25 79.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 130' ' ' ARG . 89.8 m-20 -61.09 -38.3 85.78 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.66 -30.87 78.1 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.523 ' ND2' ' HA ' ' A' ' 126' ' ' ILE . 3.6 p30 -90.59 -34.28 15.55 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.981 -1.305 . . . . 0.0 110.902 -178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.51 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 67.6 mtm180 -61.6 149.85 37.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.625 -1.297 . . . . 0.0 109.513 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.559 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -69.53 137.62 52.63 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.513 -0.742 . . . . 0.0 109.749 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -85.49 0.61 51.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.868 . . . . 0.0 108.958 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.999 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.024 0 O4'-C1'-C2' 108.344 2.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.523 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.226 0 O4'-C1'-C2' 108.711 2.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.855 0 O4'-C4'-C3' 107.563 1.963 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.93 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.197 0 O4'-C4'-C3' 107.536 1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.154 0 O5'-C5'-C4' 113.196 2.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . 0.551 ' OP2' ' NH2' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.812 0 O4'-C4'-C3' 107.618 2.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.608 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.608 1.464 0 O4'-C1'-C2' 108.515 2.196 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.981 0 O5'-C5'-C4' 112.915 1.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.414 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 P--O5' 1.613 2.009 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.674 0 O5'-C5'-C4' 113.267 2.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.748 0 O4'-C4'-C3' 107.834 2.234 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.696 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O5'-C5'-C4' 112.629 1.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O4'-C4'-C3' 107.899 2.299 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.455 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -2.009 0 O4'-C1'-C2' 107.794 1.54 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.455 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.14 0 O4'-C1'-C2' 108.785 2.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.275 0 O5'-C5'-C4' 112.538 1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.559 0 O5'-C5'-C4' 113.621 2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.424 ' OP1' ' OD1' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.866 0 O4'-C4'-C3' 107.833 2.233 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O5'-C5'-C4' 113.194 2.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.24 0 O5'-C5'-C4' 113.488 2.349 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O5'-C5'-C4' 113.529 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C1'-C2' 108.747 2.406 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.514 0 O5'-C5'-C4' 113.736 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.385 0 O4'-C4'-C3' 107.482 1.882 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.663 0 O4'-C4'-C3' 107.749 2.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.784 0 O5'-C5'-C4' 113.008 2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.942 0 O5'-C5'-C4' 113.316 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.708 0 O4'-C4'-C3' 107.573 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.592 ' O ' ' N ' ' A' ' 5' ' ' SER . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.449 ' C ' ' O ' ' A' ' 3' ' ' GLY . 55.6 t90 -39.45 91.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.43 -1.041 . . . . 0.0 109.79 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 3' ' ' GLY . 0.3 OUTLIER -110.69 140.59 44.92 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.523 -0.736 . . . . 0.0 109.448 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -55.49 -40.14 71.32 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.476 -0.765 . . . . 0.0 110.339 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -64.7 -42.36 95.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.919 -1.113 . . . . 0.0 109.587 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -57.77 -39.26 77.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.815 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.818 ' O ' HG12 ' A' ' 13' ' ' VAL . 2.9 mm-40 -71.23 -37.46 72.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.277 -0.889 . . . . 0.0 109.011 179.219 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.3 -49.57 66.72 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.88 . . . . 0.0 109.768 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -61.56 -37.61 84.47 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.162 -0.961 . . . . 0.0 109.275 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -65.77 -53.32 42.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.166 -0.959 . . . . 0.0 110.956 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.818 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -72.76 -36.16 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.995 -1.066 . . . . 0.0 109.707 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -60.99 -40.99 95.57 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.261 -1.524 . . . . 0.0 108.421 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -59.05 -30.73 68.26 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.231 -0.918 . . . . 0.0 108.733 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.63 ' HA ' HD12 ' A' ' 19' ' ' ILE . 12.0 mt -67.31 -33.88 76.19 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.922 178.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -83.96 -40.9 17.91 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.636 -1.29 . . . . 0.0 110.723 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.8 mm-40 -57.42 -32.23 66.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.054 -1.029 . . . . 0.0 109.322 -177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 16' ' ' LEU . 5.2 mt -44.62 -43.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 O-C-N 121.423 -0.798 . . . . 0.0 109.721 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 3.9 m120 -178.04 123.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.123 -0.986 . . . . 0.0 109.781 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.495 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 51.6 p30 -86.1 68.78 10.4 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.554 -0.716 . . . . 0.0 110.789 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.4 130.94 39.84 Favored Pre-proline 0 C--N 1.303 -1.414 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -40.08 -64.16 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 C-N-CA 122.118 1.879 . . . . 0.0 112.984 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -63.89 -39.26 93.78 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.705 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.547 ' NH2' HG21 ' A' ' 19' ' ' ILE . 58.7 ttt180 -59.78 -45.99 90.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.845 -1.16 . . . . 0.0 110.38 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -61.0 -47.46 86.34 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.829 -1.17 . . . . 0.0 108.697 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.514 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 84.9 tt0 -53.03 -27.68 20.8 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.389 0.614 . . . . 0.0 109.784 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -71.89 -61.68 1.7 Allowed 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.114 -0.991 . . . . 0.0 111.33 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 16' ' ' LEU . 13.6 mt -60.27 -44.68 95.11 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.383 -0.823 . . . . 0.0 111.057 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.589 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 40.9 p-10 -64.37 -46.02 85.17 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 118.931 -1.107 . . . . 0.0 109.579 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.589 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 52.5 t0 -65.74 -43.54 88.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.289 -0.882 . . . . 0.0 109.445 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -54.63 -49.09 71.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.188 -0.945 . . . . 0.0 109.578 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.522 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 51.5 m-85 -62.1 -34.62 76.67 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.75 -1.18 . . . . 0.0 107.856 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -69.3 -55.41 10.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.536 -0.728 . . . . 0.0 110.44 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 39.2 t80 -60.52 -38.3 83.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.282 -0.886 . . . . 0.0 110.929 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.4 mmm -60.15 -36.21 77.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.007 . . . . 0.0 110.946 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -57.91 -41.2 82.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.052 . . . . 0.0 110.335 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -65.01 -37.78 88.78 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.644 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -64.48 -30.11 71.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.837 -178.637 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.36 1.21 64.59 Favored Glycine 0 N--CA 1.482 1.742 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 41.9 p -114.43 84.3 9.5 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -85.11 143.16 9.01 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.514 2.143 . . . . 0.0 110.767 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 46' ' ' LEU . 53.5 mt -80.68 99.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 120.944 -1.098 . . . . 0.0 110.008 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 80.9 m-20 -64.48 -46.83 81.35 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -138.22 133.2 32.9 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 43' ' ' ILE . 9.5 mt -70.69 147.47 94.5 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 120.84 -1.163 . . . . 0.0 109.182 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.33 106.64 1.8 Allowed 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 121.556 1.504 . . . . 0.0 109.875 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.61 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 40.6 mt -77.15 142.55 14.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.131 -0.98 . . . . 0.0 109.947 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.746 ' SD ' HG21 ' A' ' 97' ' ' THR . 69.0 mmm -134.08 127.08 31.45 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 59.87 42.6 16.17 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 59.65 25.61 14.57 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.205 0.526 . . . . 0.0 110.409 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.524 ' N ' HG23 ' A' ' 48' ' ' ILE . 95.3 p -138.02 153.53 49.37 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.129 -0.982 . . . . 0.0 109.758 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.2 m -66.88 145.07 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.027 -1.046 . . . . 0.0 109.178 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 HD22 ' A' ' 59' ' ' LEU . 46.1 tp -79.7 125.31 29.48 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.366 -0.834 . . . . 0.0 109.999 -179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.555 ' OD1' HD13 ' A' ' 19' ' ' ILE . 84.1 m-20 -68.35 89.6 0.34 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.404 -0.81 . . . . 0.0 109.301 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -52.03 -22.68 4.27 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.313 -0.867 . . . . 0.0 109.595 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.545 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 48.7 t80 -77.72 -55.38 5.39 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.06 -1.025 . . . . 0.0 111.66 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -61.81 -39.94 93.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.765 -1.209 . . . . 0.0 110.44 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.49 HD13 HD22 ' A' ' 98' ' ' LEU . 52.6 tp -59.55 -43.45 93.52 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 120.732 -1.23 . . . . 0.0 108.263 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.435 ' CE2' HG13 ' A' ' 64' ' ' ILE . 50.2 t80 -59.29 -66.75 0.46 Allowed 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.484 0.659 . . . . 0.0 109.653 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 71.8 m-20 -42.54 -39.48 2.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.61 -0.681 . . . . 0.0 110.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.47 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.6 mt -72.5 -44.74 61.84 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.448 -1.301 . . . . 0.0 107.851 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.8 t -58.8 -45.49 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.135 -0.978 . . . . 0.0 110.16 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.435 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.7 mm -67.72 -35.5 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.681 -1.262 . . . . 0.0 108.412 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.481 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.85 -25.15 26.79 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 120.261 -0.575 . . . . 0.0 110.073 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.586 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.8 mpt_? -91.17 -2.79 57.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.574 -1.329 . . . . 0.0 108.953 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.74 18.72 61.1 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.14 178.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.417 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 137.68 133.6 3.15 Favored Glycine 0 N--CA 1.501 3.031 0 CA-C-N 119.297 1.548 . . . . 0.0 111.41 178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' HH2' ' A' ' 78' ' ' TRP . 11.9 tp -51.13 -39.01 55.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.727 -0.866 . . . . 0.0 110.305 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.94 -43.3 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.037 -1.04 . . . . 0.0 109.543 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -58.05 -39.57 78.8 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.991 -1.068 . . . . 0.0 110.171 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 76' ' ' LYS . 52.2 t -64.13 -43.58 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.38 -0.825 . . . . 0.0 110.291 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.403 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 80.8 mt -66.03 -57.92 8.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 O-C-N 120.655 -1.278 . . . . 0.0 110.249 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -58.26 -41.34 84.05 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.174 -0.954 . . . . 0.0 110.415 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -92.61 -9.09 42.29 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.144 -0.973 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.0 mttp 57.67 57.3 4.34 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 -178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.539 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.7 mt -90.71 15.48 11.0 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 120.951 -1.093 . . . . 0.0 108.244 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.611 ' HH2' HD11 ' A' ' 69' ' ' LEU . 91.4 m95 -65.69 -40.27 92.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.5 -0.75 . . . . 0.0 109.121 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.607 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 5.4 mp0 -49.11 -38.71 25.63 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.389 -1.324 . . . . 0.0 108.16 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.586 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.7 mt-10 -69.76 -41.27 75.39 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.21 -52.69 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 95' ' ' ALA . 72.0 mt -50.95 -56.57 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.557 -0.714 . . . . 0.0 109.139 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -70.22 -37.23 74.99 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.169 -0.957 . . . . 0.0 110.087 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.95 -32.73 34.94 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.0 mt -92.21 -7.07 49.32 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.365 -1.08 . . . . 0.0 109.135 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 13.8 m80 68.09 40.97 2.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.746 -0.596 . . . . 0.0 110.122 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.27 140.45 85.21 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.102 -0.999 . . . . 0.0 108.844 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.557 ' C ' ' H ' ' A' ' 90' ' ' SER . 44.3 Cg_endo -70.69 141.57 41.76 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 122.181 1.92 . . . . 0.0 112.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.8 p -55.83 -0.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.399 -0.813 . . . . 0.0 109.845 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.557 ' H ' ' C ' ' A' ' 88' ' ' PRO . 84.4 p -66.51 -26.82 67.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.168 -0.958 . . . . 0.0 109.947 -178.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.422 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.3 mt -98.68 102.93 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.86 -1.15 . . . . 0.0 109.353 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.3 p -74.73 -27.79 60.51 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.044 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.5 m -94.2 37.82 1.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.475 -0.766 . . . . 0.0 109.196 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.69 -65.09 0.74 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.32 -0.862 . . . . 0.0 108.903 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.641 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.62 -51.7 20.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -0.894 . . . . 0.0 109.619 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.532 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 5.8 tp -58.73 -43.89 90.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.934 -1.104 . . . . 0.0 109.173 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.746 HG21 ' SD ' ' A' ' 49' ' ' MET . 10.6 m -62.69 -41.22 99.0 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.036 -1.04 . . . . 0.0 108.827 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.49 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -67.61 -43.08 81.31 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.428 -0.795 . . . . 0.0 109.509 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.707 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.7 ttm180 -68.62 -51.45 42.13 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.338 -0.851 . . . . 0.0 111.291 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.2 m -55.17 -52.32 63.69 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.195 -0.941 . . . . 0.0 110.009 -178.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -62.87 -42.09 99.63 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.201 -0.937 . . . . 0.0 111.377 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.6 t80 -58.55 -42.23 87.41 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.453 -1.404 . . . . 0.0 110.074 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.569 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.2 ttm -53.36 -54.79 31.46 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.377 -0.827 . . . . 0.0 111.253 -178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -73.45 -54.71 7.61 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.936 -1.102 . . . . 0.0 113.068 -176.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.413 ' C ' HD12 ' A' ' 106' ' ' LEU . 51.9 m-85 -84.07 -46.39 12.03 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.679 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.1 mp -96.02 -5.9 40.02 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.189 -1.569 . . . . 0.0 113.631 -176.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.641 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 83.2 t80 -59.89 -37.01 44.65 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 119.966 -1.708 . . . . 0.0 110.123 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.637 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 13.4 Cg_exo -69.03 -52.86 0.35 Allowed 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.378 2.052 . . . . 0.0 112.501 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -59.91 -42.52 94.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.408 -0.807 . . . . 0.0 109.587 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -69.42 -51.53 35.52 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.35 -0.844 . . . . 0.0 110.324 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 71.4 m -70.8 -42.36 70.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.348 -0.845 . . . . 0.0 110.49 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -66.81 -51.48 55.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.837 -1.164 . . . . 0.0 111.149 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -74.28 -26.12 60.01 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.035 -1.04 . . . . 0.0 111.408 -178.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.485 ' HG2' HD21 ' A' ' 116' ' ' LEU . 38.5 tptt -125.76 -29.73 3.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.977 -1.077 . . . . 0.0 111.607 -177.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.554 ' N ' ' O ' ' A' ' 111' ' ' CYS . 37.4 t30 55.96 45.82 23.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.685 -1.259 . . . . 0.0 109.885 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.485 HD21 ' HG2' ' A' ' 114' ' ' LYS . 53.3 mt -66.77 -33.14 74.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.267 -0.895 . . . . 0.0 111.174 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.496 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 10.7 t -155.57 -161.09 1.11 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 118.893 -1.123 . . . . 0.0 111.341 -178.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 71.1 p -125.53 164.22 33.85 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.738 -0.601 . . . . 0.0 109.66 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.495 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 16.5 Cg_exo -64.54 -36.14 44.63 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.549 1.499 . . . . 0.0 111.873 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.29 82.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.098 -1.001 . . . . 0.0 109.356 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 48.3 mt-10 -67.33 -45.22 77.06 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.569 HD21 ' HG3' ' A' ' 103' ' ' MET . 14.7 tp -66.2 -50.87 62.38 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.486 -0.759 . . . . 0.0 109.501 178.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -59.05 -46.17 88.9 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.098 -1.001 . . . . 0.0 109.311 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.73 97.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.373 -0.829 . . . . 0.0 110.381 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.69 73.63 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.508 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.1 mt -66.63 -51.16 59.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.08 -39.52 94.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.467 -0.77 . . . . 0.0 109.791 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -30.56 72.16 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.707 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 28.6 p30 -89.57 -24.99 21.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.335 -1.097 . . . . 0.0 110.299 -178.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.645 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -62.83 141.13 58.77 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.998 -1.064 . . . . 0.0 109.595 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.518 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.4 mpt_? -66.35 150.26 49.14 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.428 -0.795 . . . . 0.0 110.014 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.94 -20.68 58.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.43 -0.794 . . . . 0.0 109.336 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.998 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.875 ' H6 ' " O5'" ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C1'-C2' 108.833 2.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.088 0 O4'-C4'-C3' 107.962 2.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.981 0 O4'-C4'-C3' 107.452 1.852 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.212 0 O5'-C5'-C4' 113.288 2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.955 0 O5'-C5'-C4' 113.087 2.062 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.022 0 O4'-C4'-C3' 107.668 2.068 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.675 0 O4'-C4'-C3' 107.656 2.056 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.61 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.194 0 O4'-C1'-C2' 108.426 2.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.254 0 O5'-C5'-C4' 113.251 2.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.127 0 O4'-C4'-C3' 107.826 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.849 0 O5'-C5'-C4' 112.995 1.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.157 0 O4'-C4'-C3' 107.835 2.235 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.018 0 O4'-C4'-C3' 107.692 2.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.976 0 O4'-C4'-C3' 107.413 1.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.023 0 O4'-C4'-C3' 107.901 2.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.463 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.422 -2.209 0 C4'-C3'-C2' 104.618 1.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.133 0 O4'-C1'-C2' 108.726 2.387 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.511 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.006 0 O5'-C5'-C4' 112.56 1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.511 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.792 0 O5'-C5'-C4' 113.788 2.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.795 0 O4'-C4'-C3' 107.686 2.086 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.532 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.805 0 O4'-C4'-C3' 107.772 2.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.67 0 O5'-C5'-C4' 113.336 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.781 0 O5'-C5'-C4' 113.613 2.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.055 0 O4'-C1'-C2' 108.83 2.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.097 0 O4'-C4'-C3' 107.93 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C4'-C3' 107.693 2.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.238 0 O4'-C4'-C3' 107.923 2.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.738 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.844 0 O4'-C4'-C3' 107.8 2.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.753 0 O4'-C4'-C3' 107.381 1.781 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.452 ' CH2' ' OD1' ' A' ' 44' ' ' ASN . 33.6 p90 -76.24 142.25 41.48 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.234 -1.157 . . . . 0.0 109.566 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.14 135.41 39.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 109.613 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -54.62 -36.72 64.8 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.398 -0.814 . . . . 0.0 110.036 -178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -64.51 -41.71 96.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.949 -1.094 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -54.4 -43.85 71.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.908 . . . . 0.0 109.719 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.887 ' O ' HG12 ' A' ' 13' ' ' VAL . 47.8 mt-30 -69.59 -37.11 76.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.0 -1.063 . . . . 0.0 109.81 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -48.56 -49.28 37.19 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 109.791 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -61.76 -40.04 93.75 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.418 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -67.42 -53.24 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.368 -0.833 . . . . 0.0 111.549 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.887 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.1 p -69.69 -38.72 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.038 -1.039 . . . . 0.0 110.197 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -60.72 -39.28 88.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.125 -1.61 . . . . 0.0 108.258 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -58.31 -29.44 65.89 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.229 -0.92 . . . . 0.0 108.68 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 46' ' ' LEU . 9.6 mt -69.75 -40.22 76.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.44 -0.787 . . . . 0.0 111.464 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.454 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 91.4 m-85 -75.22 -36.83 61.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.402 -1.436 . . . . 0.0 109.864 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.481 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -62.32 -28.13 69.52 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 110.81 -177.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.634 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.3 mt -37.43 -41.42 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 O-C-N 121.602 -0.686 . . . . 0.0 110.738 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 50.9 p-10 -172.82 168.18 5.08 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.733 -1.229 . . . . 0.0 110.598 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -90.97 65.5 5.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.614 -0.678 . . . . 0.0 110.526 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.65 137.3 20.21 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.201 -0.937 . . . . 0.0 108.563 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.88 -61.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.078 1.852 . . . . 0.0 112.262 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -34.89 71.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.132 -0.98 . . . . 0.0 109.581 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.634 ' NH2' HD13 ' A' ' 19' ' ' ILE . 59.6 ttt180 -58.48 -42.22 87.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.179 -0.95 . . . . 0.0 110.166 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -60.29 -53.29 59.36 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.86 -1.136 . . . . 0.0 108.482 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.22 -35.55 60.05 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.567 -0.708 . . . . 0.0 109.244 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -64.45 -61.84 1.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.448 -0.783 . . . . 0.0 110.995 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 16' ' ' LEU . 70.7 mt -55.07 -46.96 75.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.915 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 39.1 m-20 -62.65 -46.64 87.29 Favored 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.492 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -67.17 -43.59 81.86 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.018 -1.051 . . . . 0.0 109.448 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.9 tp -56.32 -50.59 71.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 -179.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -61.78 -34.13 75.32 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.108 -1.437 . . . . 0.0 107.709 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.4 m -69.51 -53.02 21.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 109.553 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.419 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 60.0 t80 -59.14 -44.0 92.05 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.499 -0.751 . . . . 0.0 110.304 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 73.4 mmm -59.03 -37.46 77.03 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.666 -0.646 . . . . 0.0 110.462 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -59.39 -41.53 89.59 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.095 -1.003 . . . . 0.0 109.97 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.62 -46.34 79.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.511 HH11 ' HB2' ' A' ' 108' ' ' PRO . 2.8 mtp180 -62.59 -23.68 67.16 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.336 -0.852 . . . . 0.0 110.719 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.41 2.08 60.45 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 68.2 p -117.24 83.36 15.72 Favored Pre-proline 0 N--CA 1.493 1.693 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -86.98 145.62 7.58 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.987 2.458 . . . . 0.0 111.7 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD23 ' A' ' 46' ' ' LEU . 47.6 mt -79.86 98.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.082 -1.011 . . . . 0.0 109.142 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.452 ' OD1' ' CH2' ' A' ' 4' ' ' TRP . 79.0 m-20 -63.14 -45.14 93.35 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -138.51 134.91 34.53 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.596 HD23 HG21 ' A' ' 43' ' ' ILE . 12.0 mt -70.93 144.62 90.64 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.816 -1.178 . . . . 0.0 109.463 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.78 116.29 4.66 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 121.587 1.524 . . . . 0.0 109.425 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.608 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 52.7 mt -82.59 144.19 10.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.001 -1.062 . . . . 0.0 110.061 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 46.9 mmm -139.59 124.97 19.06 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.7 41.06 3.09 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -177.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.3 mttm 59.16 22.69 10.89 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.342 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.494 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -140.02 157.43 45.68 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.987 -1.071 . . . . 0.0 110.133 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.7 m -66.73 144.3 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 120.964 -1.085 . . . . 0.0 109.019 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.559 HD21 HD22 ' A' ' 59' ' ' LEU . 44.0 tp -78.63 124.07 27.79 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.364 -0.835 . . . . 0.0 109.767 -179.008 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.515 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.0 m-20 -65.74 90.68 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.441 -0.787 . . . . 0.0 109.246 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 mt -55.44 -23.85 27.53 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.075 -1.016 . . . . 0.0 109.186 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -80.31 -57.94 3.37 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.179 -0.951 . . . . 0.0 111.58 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.7 -38.78 79.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.55 -1.344 . . . . 0.0 108.88 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.559 HD22 HD21 ' A' ' 54' ' ' LEU . 53.7 tp -58.18 -46.2 86.16 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.429 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.5 t80 -59.45 -66.18 0.55 Allowed 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.453 0.644 . . . . 0.0 109.303 178.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -42.04 -40.77 2.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.508 -0.745 . . . . 0.0 110.571 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.1 mt -71.69 -45.73 60.97 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.011 -1.476 . . . . 0.0 107.797 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.809 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.3 t -56.18 -45.07 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.137 -0.977 . . . . 0.0 110.253 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.429 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.7 mm -67.99 -35.98 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.665 -1.272 . . . . 0.0 107.894 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.31 -20.79 45.93 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 21.2 mmt-85 -93.88 0.81 56.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.579 -1.326 . . . . 0.0 108.443 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.39 13.62 73.12 Favored Glycine 0 N--CA 1.492 2.395 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.981 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.42 135.92 3.42 Favored Glycine 0 N--CA 1.502 3.058 0 CA-C-N 119.366 1.583 . . . . 0.0 111.391 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' CH2' ' A' ' 78' ' ' TRP . 11.0 tp -52.42 -39.62 61.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.553 -0.969 . . . . 0.0 110.374 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.506 HG22 ' HA ' ' A' ' 122' ' ' LEU . 85.3 t -58.74 -45.1 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.02 -1.05 . . . . 0.0 109.772 -178.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.33 -39.16 69.65 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.029 -1.045 . . . . 0.0 108.651 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.8 t -63.94 -41.23 91.84 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.506 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.403 HG12 ' NH1' ' A' ' 99' ' ' ARG . 64.0 mt -66.96 -61.86 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 O-C-N 120.82 -1.175 . . . . 0.0 110.384 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -57.73 -40.16 78.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.192 -0.942 . . . . 0.0 110.215 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -91.61 -11.63 36.6 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.172 -0.955 . . . . 0.0 110.685 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.1 mtmt 58.73 60.11 2.64 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -178.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -94.63 14.44 21.03 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.935 -1.103 . . . . 0.0 108.773 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.611 ' CH2' HD11 ' A' ' 69' ' ' LEU . 81.6 m95 -62.97 -39.52 94.95 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.124 -0.985 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 78' ' ' TRP . 95.4 mm-40 -48.85 -39.39 25.46 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.379 -1.451 . . . . 0.0 108.371 178.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 79.0 mm-40 -66.25 -39.93 89.84 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.406 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -73.67 -50.55 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.553 -0.717 . . . . 0.0 109.211 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.781 HD11 ' HB2' ' A' ' 95' ' ' ALA . 79.7 mt -51.8 -54.02 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.509 -0.744 . . . . 0.0 109.5 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.41 -38.9 68.28 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.037 -1.04 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.74 -32.37 40.04 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.3 mt -90.47 -7.05 54.03 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.393 -1.063 . . . . 0.0 109.156 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 65.85 40.44 4.22 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.838 -0.539 . . . . 0.0 110.633 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.73 141.5 82.37 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 108.483 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.553 ' C ' ' H ' ' A' ' 90' ' ' SER . 57.6 Cg_endo -73.32 143.66 35.53 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.055 1.837 . . . . 0.0 112.532 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.7 m -58.06 1.42 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.356 -0.84 . . . . 0.0 109.664 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.553 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.6 p -66.57 -24.56 66.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.186 -0.947 . . . . 0.0 109.966 -178.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.544 HD11 ' H ' ' A' ' 50' ' ' ALA . 81.6 mt -103.06 107.09 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 120.989 -1.069 . . . . 0.0 109.412 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.3 p -76.48 -28.15 56.36 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 108.729 179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 m -90.26 30.95 1.04 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.531 -0.731 . . . . 0.0 109.36 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.24 -64.74 0.85 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.781 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.57 -52.73 36.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 0.0 109.409 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.96 -44.71 91.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.825 -1.172 . . . . 0.0 108.884 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.1 m -59.06 -40.87 86.46 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 59' ' ' LEU . 13.9 mt -68.75 -42.23 77.83 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.616 -0.678 . . . . 0.0 109.266 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.465 ' HG3' HH11 ' A' ' 99' ' ' ARG . 11.1 ttm-85 -65.05 -52.37 56.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.123 -0.986 . . . . 0.0 110.415 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.5 m -57.32 -53.65 55.67 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.429 -0.794 . . . . 0.0 110.341 -178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -64.79 -44.53 89.67 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.831 -1.168 . . . . 0.0 112.178 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.7 t80 -57.91 -40.12 79.62 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.087 -1.633 . . . . 0.0 108.783 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' MET . . . . . 1.013 ' SD ' HD21 ' A' ' 122' ' ' LEU . 55.8 mmm -52.55 -58.86 5.43 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.67 -0.644 . . . . 0.0 111.909 -179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -73.76 -50.8 18.89 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.559 -1.338 . . . . 0.0 112.818 -176.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.468 ' C ' HD12 ' A' ' 106' ' ' LEU . 63.8 m-85 -83.97 -48.53 9.86 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.031 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.9 mp -99.39 6.04 46.18 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.255 -1.528 . . . . 0.0 113.819 -176.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.528 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 36.0 t80 -66.58 -38.84 21.27 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.042 -1.661 . . . . 0.0 111.09 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.2 Cg_endo -78.64 -41.55 0.25 Allowed 'Trans proline' 0 N--CA 1.487 1.145 0 C-N-CA 121.472 1.448 . . . . 0.0 112.568 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.78 -42.62 89.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.85 -1.156 . . . . 0.0 108.348 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.96 -43.56 62.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.436 -0.79 . . . . 0.0 110.035 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.586 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.8 t -79.95 -46.27 17.01 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.1 -1.0 . . . . 0.0 110.927 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.8 tp10 -66.34 -45.62 79.6 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.737 -1.227 . . . . 0.0 110.634 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -75.34 -35.37 61.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.115 -0.99 . . . . 0.0 110.965 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.1 tptp -118.39 -27.15 6.06 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.012 -1.055 . . . . 0.0 111.876 -177.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 111' ' ' CYS . 36.6 t-20 55.08 45.48 26.11 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.748 -1.22 . . . . 0.0 110.474 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.2 mt -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.105 -0.997 . . . . 0.0 110.561 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.477 ' OG ' ' N ' ' A' ' 118' ' ' THR . 37.8 t -153.02 -167.03 2.61 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.153 -1.019 . . . . 0.0 111.056 -178.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.477 ' N ' ' OG ' ' A' ' 117' ' ' SER . 65.5 p -127.32 159.12 67.02 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.574 -0.704 . . . . 0.0 110.171 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -55.97 -41.94 71.89 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.691 1.594 . . . . 0.0 112.665 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.6 91.81 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.878 -1.139 . . . . 0.0 109.754 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.55 -44.37 82.51 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.013 HD21 ' SD ' ' A' ' 103' ' ' MET . 15.2 tp -66.55 -52.41 45.93 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.664 -0.648 . . . . 0.0 110.251 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -57.64 -46.18 84.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.055 -1.028 . . . . 0.0 109.554 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.78 87.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.85 -34.55 76.92 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.285 -0.885 . . . . 0.0 108.75 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.556 HD11 ' SD ' ' A' ' 103' ' ' MET . 10.4 mt -66.25 -49.09 78.59 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -61.68 -38.24 87.07 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.069 -1.019 . . . . 0.0 108.709 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.59 -28.71 73.57 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.9 p-10 -89.92 -30.19 18.02 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.694 -1.474 . . . . 0.0 110.335 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.655 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 0.0 OUTLIER -63.38 142.95 58.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.886 -1.134 . . . . 0.0 109.123 179.345 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.543 ' NH1' ' O ' ' A' ' 129' ' ' ASN . 10.4 mpt_? -69.29 144.72 53.5 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.519 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -74.43 1.02 12.75 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.408 -0.807 . . . . 0.0 109.506 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.873 ' H6 ' " O5'" ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.125 0 O4'-C1'-C2' 108.841 2.492 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.033 0 O4'-C4'-C3' 107.929 2.329 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.887 0 O4'-C4'-C3' 107.517 1.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.353 0 O4'-C4'-C3' 107.91 2.31 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O5'-C5'-C4' 113.088 2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.08 0 O5'-C5'-C4' 113.175 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.728 0 O4'-C4'-C3' 107.393 1.793 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.608 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.154 0 O4'-C4'-C3' 107.729 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.006 0 O5'-C5'-C4' 113.122 2.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.45 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.874 2.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.45 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.722 0 O5'-C5'-C4' 112.955 1.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.82 0 O5'-C5'-C4' 113.2 2.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C4'-C3' 107.725 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 0 O4'-C4'-C3' 107.371 1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.05 0 O4'-C4'-C3' 107.975 2.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.467 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.264 0 O4'-C1'-N19 106.657 -1.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.467 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O4'-C4'-C3' 108.123 2.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.405 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.528 2.095 0 O5'-C5'-C4' 112.506 1.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.804 0 O5'-C5'-C4' 113.717 2.512 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.969 0 O4'-C4'-C3' 107.66 2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.571 ' P ' HH12 ' A' ' 130' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.822 0 O5'-C5'-C4' 113.141 2.1 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.034 0 O5'-C5'-C4' 113.228 2.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.104 0 O5'-C5'-C4' 113.45 2.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.184 0 O4'-C1'-C2' 108.663 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.322 0 O4'-C4'-C3' 108.051 2.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.21 0 O4'-C4'-C3' 107.826 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.306 0 O4'-C4'-C3' 107.802 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.891 0 O4'-C4'-C3' 107.853 2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.021 0 O4'-C4'-C3' 107.74 2.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O4'-C4'-C3' 107.515 1.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 35.2 p90 -67.78 152.23 45.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.192 -1.181 . . . . 0.0 109.559 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.65 137.22 37.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.332 -0.855 . . . . 0.0 109.568 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -55.77 -37.18 68.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.441 -0.787 . . . . 0.0 109.871 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.27 -43.17 98.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.788 -1.195 . . . . 0.0 108.761 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -55.85 -40.5 72.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.333 -0.854 . . . . 0.0 108.846 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.639 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 11.4 mm100 -77.39 -37.99 50.8 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.338 -0.851 . . . . 0.0 109.59 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.01 -49.76 65.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.975 -1.078 . . . . 0.0 109.649 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -62.19 -42.14 99.0 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.172 -0.955 . . . . 0.0 109.336 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.41 ' C ' HD11 ' A' ' 46' ' ' LEU . 18.0 mm100 -65.27 -49.76 68.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.58 -0.7 . . . . 0.0 110.805 -179.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.41 HG13 ' O ' ' A' ' 9' ' ' GLN . 4.1 m -71.74 -35.99 57.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 120.692 -1.255 . . . . 0.0 108.641 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.494 ' O ' ' OE1' ' A' ' 18' ' ' GLU . 6.9 tpt180 -54.56 -40.81 69.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.614 -1.304 . . . . 0.0 107.532 178.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -58.49 -31.4 67.81 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.452 ' HA ' HD12 ' A' ' 19' ' ' ILE . 10.2 mt -72.63 -37.34 68.06 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.433 -0.792 . . . . 0.0 111.469 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -77.49 -33.13 54.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.364 -1.46 . . . . 0.0 110.009 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.503 ' O ' ' C ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -69.48 -27.86 65.58 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.088 -1.007 . . . . 0.0 111.282 -177.771 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.503 ' C ' ' O ' ' A' ' 18' ' ' GLU . 19.3 mt -35.74 -38.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.672 -0.642 . . . . 0.0 110.161 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLU . 11.3 p30 -173.56 168.24 4.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.071 -1.018 . . . . 0.0 110.153 179.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -90.86 74.43 6.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.656 -0.653 . . . . 0.0 110.044 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -108.82 134.36 20.36 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.7 -59.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 122.079 1.853 . . . . 0.0 112.305 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -58.66 -34.18 70.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.616 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.692 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -57.09 -42.12 80.16 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.016 -1.052 . . . . 0.0 109.384 -179.613 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -61.4 -54.27 45.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.903 -1.123 . . . . 0.0 108.707 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -52.97 -37.24 61.02 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -62.47 -62.57 1.66 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.48 -0.763 . . . . 0.0 109.854 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.514 HD21 HH12 ' A' ' 25' ' ' ARG . 82.0 mt -54.8 -46.34 74.47 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 121.528 0.68 . . . . 0.0 109.72 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.4 -49.65 76.01 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.003 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -66.54 -43.62 84.64 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.179 -0.95 . . . . 0.0 110.197 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.33 -52.12 64.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.967 . . . . 0.0 110.416 -178.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.448 ' CE1' HD12 ' A' ' 43' ' ' ILE . 43.9 m-85 -62.48 -32.63 73.56 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.771 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 t -67.51 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 111.311 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.597 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -63.6 -27.32 69.16 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 111.232 -178.422 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.0 mmm -64.13 -39.55 94.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.934 -1.104 . . . . 0.0 111.057 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.09 -36.39 81.56 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.939 -1.101 . . . . 0.0 110.524 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -59.4 -50.09 75.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.211 -0.931 . . . . 0.0 111.065 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB3' ' A' ' 108' ' ' PRO . 28.5 mtp180 -64.19 -19.78 65.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.807 -178.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.91 3.47 55.91 Favored Glycine 0 N--CA 1.482 1.718 0 N-CA-C 108.187 -1.965 . . . . 0.0 108.187 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.1 p -117.42 83.99 17.58 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.587 -0.949 . . . . 0.0 108.943 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.66 150.36 2.3 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 123.441 2.76 . . . . 0.0 111.755 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.639 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 55.7 mt -84.87 98.19 5.96 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 120.865 -1.147 . . . . 0.0 109.153 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -79.65 -12.95 59.8 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.466 ' CG ' ' O ' ' A' ' 45' ' ' ARG . 0.5 OUTLIER -159.4 122.93 3.72 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 43' ' ' ILE . 3.6 mt -71.46 147.1 92.41 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 120.728 -1.232 . . . . 0.0 109.349 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.82 138.14 40.15 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 121.279 1.319 . . . . 0.0 108.967 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.544 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.6 mt -105.64 146.08 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 120.9 -1.125 . . . . 0.0 110.17 -178.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.669 ' SD ' HD13 ' A' ' 54' ' ' LEU . 77.9 mtp -143.26 122.37 12.9 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.47 39.8 1.54 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 72.6 mttt 58.15 24.49 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.478 0.656 . . . . 0.0 109.654 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' HG23 ' A' ' 48' ' ' ILE . 85.8 p -138.31 157.3 46.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.533 -0.729 . . . . 0.0 109.153 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -69.54 149.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.965 -1.084 . . . . 0.0 109.472 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.68 HD21 HD22 ' A' ' 59' ' ' LEU . 59.1 tp -82.12 124.24 29.68 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.378 -0.826 . . . . 0.0 109.741 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.41 92.94 0.07 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.592 -0.693 . . . . 0.0 110.065 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -54.34 -26.21 28.57 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 120.821 -1.174 . . . . 0.0 109.318 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -78.4 -62.6 1.63 Allowed 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.951 . . . . 0.0 111.584 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.68 -36.65 67.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.685 -1.259 . . . . 0.0 109.458 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.68 HD22 HD21 ' A' ' 54' ' ' LEU . 54.6 tp -61.07 -45.63 93.97 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 178.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.456 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.8 t80 -61.83 -68.13 0.35 Allowed 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.296 0.569 . . . . 0.0 109.506 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.431 ' C ' ' O ' ' A' ' 60' ' ' TYR . 57.3 t30 -42.57 -36.98 1.52 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.405 -0.809 . . . . 0.0 109.567 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.625 HD13 ' HA ' ' A' ' 81' ' ' ILE . 8.0 mt -70.42 -50.86 34.14 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.031 -1.043 . . . . 0.0 108.448 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.866 HG21 ' CE2' ' A' ' 102' ' ' TYR . 42.3 t -58.05 -42.59 83.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.097 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.456 HG13 ' CE2' ' A' ' 60' ' ' TYR . 11.2 mm -70.14 -34.82 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.572 -1.33 . . . . 0.0 108.151 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.445 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.33 -24.1 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.735 -0.603 . . . . 0.0 110.724 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.515 ' CG ' HD13 ' A' ' 77' ' ' LEU . 8.0 mpt_? -94.14 3.72 54.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.622 -1.298 . . . . 0.0 109.564 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 16.21 69.99 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.251 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.92 134.89 3.38 Favored Glycine 0 N--CA 1.501 2.995 0 O-C-N 120.502 -1.587 . . . . 0.0 111.424 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.636 HD11 ' CH2' ' A' ' 78' ' ' TRP . 16.1 tp -52.74 -40.18 62.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.644 -0.916 . . . . 0.0 110.863 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.565 HG11 ' HB3' ' A' ' 121' ' ' GLU . 58.6 t -57.05 -42.98 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.893 -1.129 . . . . 0.0 109.318 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -57.56 -40.39 78.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.918 -1.113 . . . . 0.0 109.538 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 78.8 t -64.69 -43.19 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.376 -0.828 . . . . 0.0 110.271 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.426 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 61.1 mt -66.33 -55.4 18.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 O-C-N 120.878 -1.139 . . . . 0.0 110.273 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.5 m-20 -57.63 -42.39 83.3 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.159 -0.963 . . . . 0.0 110.266 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -93.58 -9.4 38.27 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.196 -0.94 . . . . 0.0 110.643 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 27.2 mtmm 58.56 60.17 2.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.409 -0.807 . . . . 0.0 109.849 -178.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 14.94 12.34 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.636 ' CH2' HD11 ' A' ' 69' ' ' LEU . 99.0 m95 -61.27 -40.86 95.68 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 78' ' ' TRP . 24.1 mt-30 -47.22 -39.9 15.1 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.748 -1.22 . . . . 0.0 108.673 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' ' NH2' ' A' ' 66' ' ' ARG . 76.5 mm-40 -68.54 -41.68 79.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.625 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.2 mt -69.5 -52.85 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 95' ' ' ALA . 50.5 mt -53.98 -55.34 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.607 -0.683 . . . . 0.0 109.448 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 86' ' ' HIS . 68.5 mttt -68.4 -42.27 79.27 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.336 -0.853 . . . . 0.0 109.869 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.16 -31.36 26.29 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.3 mt -91.15 -7.45 51.46 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.463 -1.022 . . . . 0.0 109.037 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 83' ' ' LYS . 71.3 m-70 62.8 42.32 8.06 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.837 -0.539 . . . . 0.0 110.124 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.7 mt -71.95 137.61 82.28 Favored Pre-proline 0 N--CA 1.488 1.453 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.586 ' C ' ' H ' ' A' ' 90' ' ' SER . 31.6 Cg_endo -66.9 141.57 59.23 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.892 1.728 . . . . 0.0 112.264 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 32.5 m -55.82 1.26 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.201 -0.937 . . . . 0.0 109.995 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.586 ' H ' ' C ' ' A' ' 88' ' ' PRO . 85.4 p -65.89 -25.35 67.13 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.099 -1.001 . . . . 0.0 109.805 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.549 HD11 ' H ' ' A' ' 50' ' ' ALA . 74.1 mt -100.47 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.064 -1.023 . . . . 0.0 109.205 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.4 p -76.98 -23.32 52.3 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.178 -0.951 . . . . 0.0 109.164 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.1 m -100.25 39.27 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.448 -0.783 . . . . 0.0 109.067 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.55 -63.75 1.05 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.87 . . . . 0.0 109.294 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.55 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.23 -51.53 14.19 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.21 -0.932 . . . . 0.0 109.612 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -59.01 -43.32 91.53 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.774 -1.204 . . . . 0.0 108.895 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 63.6 m -60.92 -41.24 95.77 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.992 -1.067 . . . . 0.0 108.531 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 95' ' ' ALA . 10.4 mt -70.19 -44.11 69.37 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.498 -0.751 . . . . 0.0 109.841 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.569 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.3 ttm-85 -67.0 -53.37 32.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.292 -0.88 . . . . 0.0 110.925 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 m -55.0 -50.06 69.95 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.029 -1.044 . . . . 0.0 109.335 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -64.2 -43.87 93.72 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.145 -0.972 . . . . 0.0 111.624 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.866 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.35 -41.42 84.64 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.422 -1.424 . . . . 0.0 109.183 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.761 ' HG2' HD21 ' A' ' 122' ' ' LEU . 81.5 mtp -50.91 -56.48 12.1 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.584 -0.697 . . . . 0.0 111.431 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.0 mttt -73.58 -55.92 5.69 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.933 -1.104 . . . . 0.0 113.15 -176.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' LEU . 56.2 m-85 -84.24 -46.4 11.87 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 115.4 1.629 . . . . 0.0 115.4 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 106' ' ' LEU . 5.8 mp -97.6 -4.87 36.75 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.212 -1.555 . . . . 0.0 113.177 -176.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 39.2 t80 -62.81 -36.65 27.3 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 120.074 -1.641 . . . . 0.0 109.466 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.6 Cg_exo -66.17 -52.74 0.79 Allowed 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 122.15 1.9 . . . . 0.0 111.678 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.29 -48.46 80.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.292 -0.88 . . . . 0.0 109.504 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.49 -47.77 69.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.118 -0.989 . . . . 0.0 110.368 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.6 t -73.99 -46.36 44.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.984 -1.073 . . . . 0.0 110.719 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.597 ' OE1' ' CZ ' ' A' ' 35' ' ' PHE . 35.2 tt0 -66.88 -51.89 50.0 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 120.904 -1.122 . . . . 0.0 111.304 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -74.57 -32.39 62.38 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.119 -0.988 . . . . 0.0 111.874 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.41 ' HG2' HD21 ' A' ' 116' ' ' LEU . 35.4 tptt -117.25 -29.69 5.82 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.895 -1.128 . . . . 0.0 111.616 -177.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 111' ' ' CYS . 19.0 t-20 54.83 44.78 27.88 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.683 -1.261 . . . . 0.0 110.481 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD21 ' HG2' ' A' ' 114' ' ' LYS . 74.7 mt -67.36 -28.33 67.86 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.992 -1.068 . . . . 0.0 110.903 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 118' ' ' THR . 4.5 t -153.61 -168.17 2.91 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.273 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.597 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.1 p -122.8 152.5 62.51 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.53 -178.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.415 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 9.5 Cg_endo -55.02 -36.76 93.45 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 C-N-CA 122.042 1.828 . . . . 0.0 112.08 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.33 83.24 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.943 -1.098 . . . . 0.0 109.243 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.565 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.7 mt-10 -65.93 -44.49 84.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 177.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 103' ' ' MET . 33.0 tp -63.56 -51.79 63.85 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.727 -0.608 . . . . 0.0 109.445 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -58.01 -50.13 74.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.241 -0.912 . . . . 0.0 109.658 178.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.24 -41.4 96.83 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.41 -0.806 . . . . 0.0 110.209 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.469 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.22 -33.57 74.66 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 103' ' ' MET . 5.5 mt -63.46 -49.78 81.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.97 -36.96 82.99 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.23 -32.98 78.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 12.4 p30 -92.59 -29.47 16.13 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.016 -1.285 . . . . 0.0 110.366 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.714 HH22 ' P ' ' C' ' 421' ' ' ' DT' . 0.0 OUTLIER -61.13 141.65 57.29 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.088 -1.007 . . . . 0.0 109.855 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.463 ' NH1' ' O ' ' A' ' 129' ' ' ASN . 11.6 mpt_? -74.43 156.62 36.8 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.429 -0.794 . . . . 0.0 109.353 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.03 111.33 23.03 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.257 -0.902 . . . . 0.0 109.191 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.917 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.848 ' H6 ' " O5'" ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C1'-C2' 108.752 2.411 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.1 0 O4'-C4'-C3' 107.942 2.342 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O5'-C5'-C4' 112.689 1.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.427 0 O5'-C5'-C4' 113.505 2.361 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.133 0 O5'-C5'-C4' 113.181 2.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.177 0 O5'-C5'-C4' 112.995 1.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.057 0 O5'-C5'-C4' 113.038 2.027 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.544 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.267 0 O4'-C1'-C2' 108.561 2.237 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . 0.416 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.217 0 O5'-C5'-C4' 113.332 2.237 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.418 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.164 0 O4'-C4'-C3' 107.854 2.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.418 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.041 0 O5'-C5'-C4' 113.255 2.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . 0.501 ' C6 ' ' N6 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.272 0 O5'-C5'-C4' 113.418 2.298 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.998 0 O4'-C4'-C3' 107.813 2.213 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C4'-C3' 107.462 1.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.314 0 O4'-C4'-C3' 107.975 2.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.819 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.949 0 O4'-C1'-C2' 109.047 2.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.382 0 O4'-C1'-C2' 108.73 2.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.501 ' N6 ' ' C6 ' ' B' ' 412' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.303 0 O5'-C5'-C4' 112.905 1.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.41 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O5'-C5'-C4' 113.771 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.172 0 O4'-C4'-C3' 107.818 2.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.714 ' P ' HH22 ' A' ' 130' ' ' ARG . . . . . . . . 0 C5'--C4' 1.528 2.097 0 O5'-C5'-C4' 113.307 2.219 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.983 0 O5'-C5'-C4' 113.578 2.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . 0.416 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.911 0 O5'-C5'-C4' 113.486 2.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.91 0 O4'-C1'-C2' 108.774 2.431 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.238 0 O5'-C5'-C4' 113.508 2.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.091 0 O4'-C4'-C3' 107.571 1.971 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.512 0 O4'-C4'-C3' 107.776 2.176 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.835 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O4'-C4'-C3' 107.99 2.39 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C4'-C3' 107.615 2.015 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -111.4 83.24 1.74 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -1.104 . . . . 0.0 109.098 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -113.56 139.66 48.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 109.12 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -55.24 -34.32 63.91 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 109.603 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.55 -45.45 90.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.056 -1.027 . . . . 0.0 109.417 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.69 -47.83 81.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.224 -0.923 . . . . 0.0 109.975 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.866 ' O ' HG12 ' A' ' 13' ' ' VAL . 35.4 mt-30 -67.22 -36.38 81.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.194 -0.941 . . . . 0.0 109.261 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.83 -47.66 51.36 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.334 -0.854 . . . . 0.0 109.052 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -62.29 -41.56 98.6 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.156 -0.965 . . . . 0.0 109.6 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -65.78 -51.14 61.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.948 . . . . 0.0 110.47 -179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.866 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.3 p -70.92 -37.05 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 120.989 -1.07 . . . . 0.0 109.845 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.608 HH11 ' CG ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -61.39 -38.37 86.82 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 119.926 -1.734 . . . . 0.0 108.03 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.17 -30.23 66.24 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.466 HD11 HD22 ' A' ' 46' ' ' LEU . 13.4 mt -69.37 -39.55 77.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.459 -0.775 . . . . 0.0 111.358 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.461 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -76.15 -35.44 59.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.375 -1.453 . . . . 0.0 110.158 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.3 mt-10 -62.21 -27.74 69.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.036 -1.04 . . . . 0.0 110.019 -177.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 29.9 mt -39.72 -41.01 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 121.7 -0.625 . . . . 0.0 110.346 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.8 m120 -170.32 157.87 6.38 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.07 -1.019 . . . . 0.0 109.341 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 58.4 p30 -94.15 63.25 3.11 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.3 144.28 27.8 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.165 -0.959 . . . . 0.0 108.942 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.25 -60.57 0.06 OUTLIER 'Trans proline' 0 C--N 1.312 -1.356 0 C-N-CA 122.164 1.909 . . . . 0.0 111.771 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' N ' ' HD2' ' A' ' 24' ' ' LYS . 4.7 mptp? -61.33 -36.1 79.23 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.307 -0.87 . . . . 0.0 109.493 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.597 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.3 ttt-85 -57.99 -45.98 85.92 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.978 -1.076 . . . . 0.0 109.192 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -61.46 -56.82 15.93 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.223 -0.923 . . . . 0.0 109.458 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -51.75 -35.25 42.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.498 -0.751 . . . . 0.0 109.585 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -63.17 -62.3 1.79 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 110.655 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.53 HD11 ' NH1' ' A' ' 25' ' ' ARG . 62.8 mt -53.23 -46.82 69.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.882 . . . . 0.0 109.322 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.461 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.1 m-20 -61.27 -46.91 88.4 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.086 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.403 -0.81 . . . . 0.0 110.067 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.621 HD23 HD13 ' A' ' 56' ' ' LEU . 63.5 tp -59.04 -50.06 75.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.028 -1.045 . . . . 0.0 110.733 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -63.06 -35.51 80.5 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.357 -1.337 . . . . 0.0 107.796 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 t -68.25 -52.52 32.99 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.522 -0.736 . . . . 0.0 109.702 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.61 -42.52 88.38 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.506 -0.746 . . . . 0.0 110.378 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.516 ' CE ' ' O ' ' A' ' 41' ' ' THR . 61.6 mmm -60.13 -38.59 83.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.478 -0.764 . . . . 0.0 111.027 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -57.7 -37.06 72.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.658 -1.276 . . . . 0.0 108.833 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -67.36 -47.88 69.12 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.338 -0.851 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 39' ' ' ARG . 2.6 mmm-85 -63.63 -22.59 66.98 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.21 -0.931 . . . . 0.0 110.798 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.24 2.81 61.94 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.516 ' O ' ' CE ' ' A' ' 36' ' ' MET . 60.0 p -116.4 83.64 13.49 Favored Pre-proline 0 N--CA 1.491 1.6 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -85.32 143.81 8.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.877 2.385 . . . . 0.0 111.196 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.7 mt -82.87 103.45 10.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 O-C-N 120.841 -1.162 . . . . 0.0 109.818 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.48 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 90.7 m-20 -67.37 -55.82 12.2 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.583 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.1 OUTLIER -127.31 133.64 50.09 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.177 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.466 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.91 146.35 92.97 Favored Pre-proline 0 C--N 1.3 -1.571 0 O-C-N 121.074 -1.016 . . . . 0.0 109.59 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -70.27 132.17 21.97 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.536 1.491 . . . . 0.0 108.967 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.563 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 9.0 mt -99.55 141.4 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 120.771 -1.206 . . . . 0.0 109.917 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.3 mtp -140.78 121.19 14.03 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 72.05 39.76 0.78 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.6 mttm 59.41 20.57 8.9 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.257 0.551 . . . . 0.0 110.161 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -139.74 159.35 42.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.093 -1.005 . . . . 0.0 109.395 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.15 146.35 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.985 -1.072 . . . . 0.0 109.414 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.7 HD21 HD22 ' A' ' 59' ' ' LEU . 57.7 tp -78.29 124.8 28.5 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.197 -0.94 . . . . 0.0 108.936 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.17 98.41 0.14 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.692 -0.63 . . . . 0.0 110.449 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.621 HD13 HD23 ' A' ' 32' ' ' LEU . 55.8 mt -56.16 -28.0 56.41 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.97 -1.081 . . . . 0.0 108.566 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -77.68 -60.77 2.23 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.178 -0.951 . . . . 0.0 111.825 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.7 -37.87 74.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.778 -1.201 . . . . 0.0 109.257 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.7 HD22 HD21 ' A' ' 54' ' ' LEU . 52.1 tp -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CE2' HG13 ' A' ' 64' ' ' ILE . 48.8 t80 -62.13 -66.91 0.47 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.674 -0.641 . . . . 0.0 110.072 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 60' ' ' TYR . 58.1 t30 -40.02 -40.86 1.12 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.537 -0.727 . . . . 0.0 111.21 -178.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 mt -73.97 -46.67 42.48 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.031 -1.467 . . . . 0.0 108.023 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.777 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.3 t -53.97 -44.15 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.001 -1.062 . . . . 0.0 109.833 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.401 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.3 mm -68.22 -36.47 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.685 -1.259 . . . . 0.0 107.794 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.82 -15.64 22.28 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.669 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.688 HH21 ' CB ' ' A' ' 80' ' ' GLU . 18.1 mmt-85 -98.27 1.71 47.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.346 -1.471 . . . . 0.0 108.554 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.31 13.01 74.77 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.42 -0.895 . . . . 0.0 111.572 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.87 137.29 3.73 Favored Glycine 0 N--CA 1.504 3.193 0 O-C-N 120.532 -1.569 . . . . 0.0 111.901 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.531 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.6 tp -51.85 -41.72 62.04 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.756 -0.85 . . . . 0.0 110.29 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 122' ' ' LEU . 93.2 t -57.78 -43.72 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.009 -1.057 . . . . 0.0 109.413 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -57.07 -40.48 76.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.067 -1.021 . . . . 0.0 109.238 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 50.8 t -61.83 -43.41 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.45 -0.781 . . . . 0.0 109.916 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.526 ' CG2' HD21 ' A' ' 129' ' ' ASN . 89.1 mt -65.9 -58.55 6.34 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 O-C-N 120.711 -1.243 . . . . 0.0 110.394 -179.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -57.74 -41.05 81.08 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.147 -0.971 . . . . 0.0 110.667 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -93.46 -9.81 37.2 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 19.2 mtmt 59.07 59.36 2.79 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.289 -0.882 . . . . 0.0 109.643 -178.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.2 mt -93.95 15.58 16.49 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.89 -1.131 . . . . 0.0 108.592 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.531 ' HH2' HD11 ' A' ' 69' ' ' LEU . 86.9 m95 -63.02 -41.68 99.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.358 -0.838 . . . . 0.0 108.924 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 29.1 mt-30 -48.86 -39.11 24.45 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.519 -1.363 . . . . 0.0 108.442 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.688 ' CB ' HH21 ' A' ' 66' ' ' ARG . 73.7 mm-40 -66.32 -38.65 88.19 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.1 mt -75.26 -52.2 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 0.0 109.09 178.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.0 mt -51.25 -53.77 13.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.323 -0.861 . . . . 0.0 109.03 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -69.75 -38.71 76.9 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.27 -0.894 . . . . 0.0 109.334 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.43 -34.36 48.69 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 88.7 mt -86.68 -8.71 57.19 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.445 -1.033 . . . . 0.0 108.587 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 64.29 40.36 6.67 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.758 -0.589 . . . . 0.0 109.901 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -74.61 143.67 79.3 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 108.996 178.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 50' ' ' ALA . 37.4 Cg_endo -70.2 143.3 48.3 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.982 1.788 . . . . 0.0 111.597 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p -60.23 1.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.892 . . . . 0.0 110.162 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 88' ' ' PRO . 91.4 p -66.43 -22.2 66.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.162 -0.962 . . . . 0.0 110.062 -178.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.547 HD11 ' H ' ' A' ' 50' ' ' ALA . 65.4 mt -100.11 106.18 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.927 -1.108 . . . . 0.0 109.346 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.7 p -78.56 -25.33 45.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -0.949 . . . . 0.0 108.714 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -93.88 32.36 1.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' O ' ' C ' ' A' ' 95' ' ' ALA . . . -63.77 -65.5 0.67 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.32 -0.863 . . . . 0.0 109.096 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.33 -52.14 17.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.99 -1.069 . . . . 0.0 108.99 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.454 ' O ' ' OG1' ' A' ' 100' ' ' THR . 8.4 tp -58.03 -44.76 87.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.097 -1.002 . . . . 0.0 109.191 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.3 m -61.78 -39.67 92.5 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.089 -1.007 . . . . 0.0 108.758 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 95' ' ' ALA . 11.2 mt -67.44 -45.16 76.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.511 -0.743 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -68.93 -49.24 59.81 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.139 -0.976 . . . . 0.0 111.219 -179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -55.01 -54.42 43.2 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 120.913 -1.117 . . . . 0.0 109.565 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -63.42 -42.38 98.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.097 -1.002 . . . . 0.0 111.777 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.777 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.13 -42.73 81.47 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.162 -1.586 . . . . 0.0 109.142 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.758 ' SD ' HD11 ' A' ' 126' ' ' ILE . 84.7 mtp -54.41 -56.21 20.94 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.623 -0.673 . . . . 0.0 112.337 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -71.4 -48.89 46.97 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.28 -1.512 . . . . 0.0 112.392 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.516 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -86.29 -52.35 5.69 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -174.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.751 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.0 mp -98.0 12.15 35.2 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.287 -1.508 . . . . 0.0 113.74 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.569 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 55.2 t80 -66.89 -37.15 13.15 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 119.93 -1.731 . . . . 0.0 111.638 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.7 Cg_endo -82.47 -38.75 0.17 Allowed 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.705 1.604 . . . . 0.0 112.532 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.7 -41.39 86.19 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -72.02 -49.34 37.69 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.569 -0.707 . . . . 0.0 109.926 179.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.8 OUTLIER -73.82 -45.48 51.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.324 -0.86 . . . . 0.0 110.891 -178.615 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.43 -47.77 72.15 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.057 -1.027 . . . . 0.0 110.905 -178.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 22.0 mmtp -77.02 -27.33 54.54 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 120.978 -1.076 . . . . 0.0 111.333 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.483 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.8 tptp -125.3 -29.27 3.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.9 -1.125 . . . . 0.0 111.536 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 111' ' ' CYS . 61.6 t30 59.45 45.13 14.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.59 -1.319 . . . . 0.0 109.987 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.483 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.5 mt -67.82 -33.63 75.16 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.301 -0.875 . . . . 0.0 111.211 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 118' ' ' THR . 28.8 t -154.28 -166.98 2.49 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.627 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.547 ' N ' ' OG ' ' A' ' 117' ' ' SER . 77.9 p -128.45 163.36 45.08 Favored Pre-proline 0 N--CA 1.498 1.934 0 O-C-N 121.795 -0.566 . . . . 0.0 109.86 -178.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.413 ' CD ' ' OH ' ' A' ' 107' ' ' TYR . 35.9 Cg_exo -59.7 -40.31 65.71 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 121.763 1.642 . . . . 0.0 112.404 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.08 -37.94 89.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.825 -1.172 . . . . 0.0 109.665 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.406 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -67.0 -44.92 79.13 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.692 HD21 ' HG2' ' A' ' 103' ' ' MET . 19.1 tp -66.51 -53.19 37.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.597 -0.69 . . . . 0.0 110.275 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -56.18 -46.55 79.34 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 108.982 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.79 -39.31 88.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.468 -0.77 . . . . 0.0 109.77 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.51 76.48 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.233 -0.917 . . . . 0.0 108.664 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.758 HD11 ' SD ' ' A' ' 103' ' ' MET . 16.9 mt -65.01 -49.48 79.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.89 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -62.08 -37.94 86.93 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.44 -32.72 85.15 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.526 HD21 ' CG2' ' A' ' 73' ' ' ILE . 6.3 p30 -93.94 -33.51 13.44 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.805 -1.409 . . . . 0.0 110.592 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.464 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 54.6 mtp180 -63.04 143.78 57.47 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.748 -1.22 . . . . 0.0 109.616 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.506 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -60.09 154.49 19.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.833 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -87.27 107.11 18.35 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.093 -1.005 . . . . 0.0 109.793 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.424 -1.471 . . . . 0.0 109.424 179.754 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -1.974 0 O4'-C1'-C2' 108.202 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.526 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C1'-C2' 108.503 2.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.869 0 O4'-C4'-C3' 107.345 1.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.181 0 O4'-C4'-C3' 107.77 2.17 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.146 0 O5'-C5'-C4' 113.152 2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.349 0 O5'-C5'-C4' 113.311 2.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.232 0 O5'-C5'-C4' 112.924 1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.563 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.606 1.339 0 C4'-C3'-C2' 105.296 2.096 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.042 0 O5'-C5'-C4' 113.254 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O5'-C5'-C4' 113.367 2.262 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.955 0 O5'-C5'-C4' 113.032 2.023 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . 0.403 ' C6 ' ' N6 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.977 0 O5'-C5'-C4' 113.143 2.102 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.732 0 O4'-C4'-C3' 107.766 2.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.827 0 O4'-C4'-C3' 107.277 1.677 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.89 0 O4'-C4'-C3' 107.941 2.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.463 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.244 0 O4'-C1'-C2' 107.806 1.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.444 0 O4'-C1'-C2' 108.748 2.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.467 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.255 0 O5'-C5'-C4' 112.487 1.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.467 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.59 0 O5'-C5'-C4' 113.62 2.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C4'-C3' 107.681 2.081 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.587 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O5'-C5'-C4' 113.428 2.306 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.587 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.993 0 O5'-C5'-C4' 113.452 2.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.767 0 O5'-C5'-C4' 113.389 2.278 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.305 0 O5'-C5'-C4' 113.524 2.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.059 0 O4'-C4'-C3' 108.023 2.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C4'-C3' 107.71 2.11 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.773 0 O4'-C4'-C3' 107.802 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.903 0 O5'-C5'-C4' 113.065 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.141 0 O5'-C5'-C4' 113.041 2.029 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.462 1.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.376 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 28.3 p90 -67.05 152.02 46.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.218 -1.166 . . . . 0.0 109.624 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.69 141.05 29.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.323 -0.86 . . . . 0.0 109.543 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -54.96 -38.82 68.23 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.452 -0.78 . . . . 0.0 110.755 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -62.5 -42.0 99.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.834 -1.166 . . . . 0.0 109.179 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -56.07 -40.34 73.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.298 -0.876 . . . . 0.0 109.24 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.708 ' O ' HG13 ' A' ' 13' ' ' VAL . 11.1 mm100 -72.65 -37.27 68.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.185 -0.947 . . . . 0.0 109.879 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CE1' ' NE ' ' A' ' 14' ' ' ARG . 84.6 t80 -58.75 -52.54 65.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.213 -0.93 . . . . 0.0 109.733 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -61.5 -47.11 87.11 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.272 -0.893 . . . . 0.0 109.889 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.438 ' O ' HD11 ' A' ' 46' ' ' LEU . 90.4 mt-30 -63.85 -50.42 68.93 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.418 -0.801 . . . . 0.0 110.896 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.708 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.4 m -69.48 -34.61 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 120.61 -1.306 . . . . 0.0 108.595 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.64 ' NE ' ' CE1' ' A' ' 10' ' ' PHE . 13.1 mmt180 -62.68 -39.95 95.56 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.512 -1.367 . . . . 0.0 107.787 178.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -56.71 -26.02 55.83 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.496 ' CD1' HD13 ' A' ' 46' ' ' LEU . 7.7 mt -78.66 -37.59 41.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.536 -0.727 . . . . 0.0 111.835 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.42 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -79.35 -31.08 42.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.389 -1.445 . . . . 0.0 110.468 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -63.61 -29.81 71.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.882 -1.136 . . . . 0.0 109.639 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.513 HD13 HH22 ' A' ' 25' ' ' ARG . 56.9 mt -43.07 -45.47 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 O-C-N 121.571 -0.705 . . . . 0.0 110.248 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.456 ' OD1' ' O ' ' A' ' 20' ' ' ASN . 26.4 p30 179.98 125.46 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.238 -0.914 . . . . 0.0 108.618 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -82.21 78.1 8.93 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 111.416 -177.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -98.01 124.23 48.36 Favored Pre-proline 0 N--CA 1.489 1.487 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -36.39 -57.52 0.58 Allowed 'Trans proline' 0 C--N 1.313 -1.295 0 C-N-CA 122.208 1.938 . . . . 0.0 113.22 -178.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -62.78 -42.07 99.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.047 -1.033 . . . . 0.0 110.76 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.513 HH22 HD13 ' A' ' 19' ' ' ILE . 60.7 ttt180 -60.67 -45.13 95.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.809 -1.182 . . . . 0.0 111.678 -178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -59.89 -51.18 70.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.37 -1.456 . . . . 0.0 108.701 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -54.68 -36.46 64.67 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -59.11 -66.04 0.57 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.277 -0.889 . . . . 0.0 110.221 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.8 mt -55.95 -43.0 77.04 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.495 0.664 . . . . 0.0 109.535 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -60.36 -50.25 74.34 Favored 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.305 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -66.98 -43.56 82.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.227 -0.921 . . . . 0.0 109.838 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.456 ' O ' ' CG ' ' A' ' 36' ' ' MET . 46.9 tp -54.69 -54.07 46.62 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.336 -0.853 . . . . 0.0 110.198 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.34 -33.64 75.97 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.594 -1.316 . . . . 0.0 108.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.6 t -69.81 -63.19 1.12 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.618 -0.676 . . . . 0.0 111.271 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.467 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -62.01 -32.09 72.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.111 -0.993 . . . . 0.0 110.723 -178.511 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.456 ' CG ' ' O ' ' A' ' 32' ' ' LEU . 62.2 mmm -59.43 -34.92 73.1 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.985 -1.072 . . . . 0.0 109.866 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -61.59 -40.15 93.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.242 -0.911 . . . . 0.0 110.321 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -58.43 -48.08 81.87 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.474 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.3 OUTLIER -63.71 -21.93 66.65 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.385 -0.822 . . . . 0.0 110.559 -178.35 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.62 7.43 60.26 Favored Glycine 0 N--CA 1.481 1.643 0 N-CA-C 107.837 -2.105 . . . . 0.0 107.837 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 p -117.89 85.2 22.33 Favored Pre-proline 0 N--CA 1.492 1.641 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -93.73 146.72 2.13 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 123.346 2.697 . . . . 0.0 112.154 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.2 mt -79.22 95.59 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 109.535 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.453 ' O ' ' OE1' ' A' ' 9' ' ' GLN . 89.7 m-20 -59.37 -28.58 67.0 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -160.64 138.22 9.44 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.496 HD13 ' CD1' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -71.69 145.2 89.43 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 120.976 -1.078 . . . . 0.0 108.544 -179.365 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -66.77 131.34 25.51 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.235 1.29 . . . . 0.0 109.215 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.541 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 8.9 mt -97.39 143.31 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 120.903 -1.123 . . . . 0.0 110.126 -178.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.687 ' SD ' HD13 ' A' ' 54' ' ' LEU . 75.1 mtp -138.98 121.92 16.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 67.78 40.56 2.4 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.1 mttm 57.17 24.24 9.54 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.47 0.652 . . . . 0.0 109.459 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.2 m -135.43 153.42 51.79 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.38 -0.825 . . . . 0.0 109.144 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -70.44 146.64 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.055 -1.028 . . . . 0.0 109.328 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.687 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.4 tp -79.14 123.8 27.72 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.402 -0.811 . . . . 0.0 110.445 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -65.49 88.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 56' ' ' LEU . 19.3 mt -54.42 -24.1 18.56 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 120.995 -1.066 . . . . 0.0 109.552 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.627 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 41.7 t80 -82.29 -56.6 3.81 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 111.735 -178.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.54 -38.49 81.16 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.531 -1.356 . . . . 0.0 109.321 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.467 HD22 HD21 ' A' ' 54' ' ' LEU . 53.6 tp -57.46 -46.49 83.59 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.436 ' CE2' HG13 ' A' ' 64' ' ' ILE . 46.3 t80 -56.98 -64.58 0.83 Allowed 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.627 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 10.7 m-20 -44.3 -40.16 5.06 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.389 -0.819 . . . . 0.0 111.128 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 66' ' ' ARG . 6.9 mt -72.07 -44.34 63.46 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 118.085 -1.446 . . . . 0.0 107.518 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.744 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -60.09 -44.49 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 60' ' ' TYR . 12.3 mm -67.91 -36.5 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.467 -1.396 . . . . 0.0 107.981 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.452 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.4 -20.84 21.39 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.174 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.608 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -93.41 1.5 56.85 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.596 -1.315 . . . . 0.0 109.304 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.89 15.29 75.56 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.014 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.73 2.97 Favored Glycine 0 N--CA 1.498 2.816 0 O-C-N 120.463 -1.61 . . . . 0.0 111.309 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.6 tp -48.45 -38.13 19.05 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.71 -0.876 . . . . 0.0 110.785 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.454 HG22 ' HA ' ' A' ' 122' ' ' LEU . 97.0 t -57.95 -41.74 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 120.846 -1.159 . . . . 0.0 110.476 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -58.78 -37.6 76.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.97 . . . . 0.0 109.914 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' LYS . 21.2 t -66.13 -42.5 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 110.643 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.408 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 48.3 mt -69.48 -57.92 7.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 120.828 -1.17 . . . . 0.0 110.548 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.406 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 92.8 m-20 -58.01 -41.53 83.33 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.047 -1.033 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -92.4 -7.98 46.15 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.261 -0.899 . . . . 0.0 110.428 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.7 mttp 58.12 55.69 5.03 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.309 -0.87 . . . . 0.0 110.592 -179.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 11.1 mt -90.61 12.45 18.86 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.699 -1.25 . . . . 0.0 107.835 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.562 ' CH2' HD11 ' A' ' 69' ' ' LEU . 98.3 m95 -62.31 -41.34 98.46 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.465 ' NE2' " H3'" ' C' ' 418' ' ' ' DA' . 91.6 mm-40 -48.86 -37.71 20.33 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.737 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.608 ' CB ' HH21 ' A' ' 66' ' ' ARG . 93.3 mt-10 -69.62 -40.82 76.35 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -67.49 -53.51 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.489 HD11 ' HB2' ' A' ' 95' ' ' ALA . 62.6 mt -51.27 -57.65 2.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.299 -0.876 . . . . 0.0 109.266 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -66.83 -37.4 84.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.153 -0.967 . . . . 0.0 109.467 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.42 ' O ' ' CE1' ' A' ' 86' ' ' HIS . . . -53.91 -37.59 58.21 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.71 -8.71 58.75 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.329 -1.101 . . . . 0.0 108.17 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.42 ' CE1' ' O ' ' A' ' 84' ' ' GLY . 18.7 m80 69.0 41.16 1.48 Allowed 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.236 0.541 . . . . 0.0 110.844 179.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -73.4 148.44 88.23 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.196 -0.94 . . . . 0.0 108.789 177.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.29 170.25 18.75 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.301 2.001 . . . . 0.0 112.282 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.5 t -79.55 -1.74 39.16 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.46 -0.775 . . . . 0.0 109.4 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 24.4 m -65.06 -33.97 77.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.504 -0.748 . . . . 0.0 110.652 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.532 HD11 ' H ' ' A' ' 50' ' ' ALA . 86.0 mt -92.76 98.89 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 120.637 -1.289 . . . . 0.0 109.263 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 31.9 p -72.21 -30.49 64.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.077 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.4 m -97.5 45.19 1.03 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.496 -0.752 . . . . 0.0 109.43 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -59.55 3.34 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.113 -0.992 . . . . 0.0 108.868 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.489 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.18 -50.55 15.57 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.197 -0.939 . . . . 0.0 109.633 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.466 ' O ' ' OG1' ' A' ' 100' ' ' THR . 7.4 tp -58.19 -43.75 87.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.681 -1.262 . . . . 0.0 109.023 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.1 m -62.5 -40.76 97.77 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.055 -1.028 . . . . 0.0 108.822 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 95' ' ' ALA . 9.3 mt -69.3 -42.87 74.87 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.562 -0.711 . . . . 0.0 110.252 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.764 ' NH1' HD21 ' A' ' 129' ' ' ASN . 46.4 ttp180 -69.24 -50.11 50.11 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.155 -0.966 . . . . 0.0 110.859 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -54.31 -54.58 38.36 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.026 -1.046 . . . . 0.0 109.419 -179.015 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -62.86 -41.19 99.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.16 -0.962 . . . . 0.0 111.468 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.744 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.5 t80 -58.16 -43.93 87.65 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 119.826 -1.796 . . . . 0.0 109.153 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.658 ' HG2' HD21 ' A' ' 122' ' ' LEU . 86.3 mtp -51.96 -56.52 13.69 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.78 -0.575 . . . . 0.0 112.097 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.1 mttm -73.48 -51.08 18.38 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.517 -1.364 . . . . 0.0 112.553 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.53 ' C ' HD12 ' A' ' 106' ' ' LEU . 69.7 m-85 -85.49 -48.1 9.28 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -174.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.8 mp -97.5 -1.51 43.93 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.23 -1.544 . . . . 0.0 113.433 -176.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.656 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 66.2 t80 -64.15 -36.06 18.06 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 119.865 -1.772 . . . . 0.0 109.709 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 10.6 Cg_exo -66.81 -51.73 0.83 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 C-N-CA 121.801 1.667 . . . . 0.0 111.213 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -58.03 -50.29 73.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.233 -0.917 . . . . 0.0 109.271 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.45 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 85.9 tt0 -65.67 -43.94 87.76 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.296 -0.878 . . . . 0.0 110.843 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.3 -45.31 18.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.983 . . . . 0.0 110.422 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 108' ' ' PRO . 32.0 tt0 -67.65 -51.87 44.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.269 -0.894 . . . . 0.0 111.417 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -75.33 -29.62 60.03 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -0.97 . . . . 0.0 111.961 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.504 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.5 tptp -123.33 -28.92 3.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.972 -1.08 . . . . 0.0 111.852 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 30.0 t30 57.86 46.02 17.51 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.742 -1.224 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.504 HD21 ' HG2' ' A' ' 114' ' ' LYS . 93.7 mt -65.86 -31.79 72.94 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.917 -1.114 . . . . 0.0 110.94 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.595 ' OG ' ' N ' ' A' ' 118' ' ' THR . 10.7 t -153.91 -167.01 2.53 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 119.001 -1.08 . . . . 0.0 111.192 -178.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.595 ' N ' ' OG ' ' A' ' 117' ' ' SER . 53.9 p -129.35 155.55 79.86 Favored Pre-proline 0 N--CA 1.5 2.054 0 O-C-N 121.474 -0.766 . . . . 0.0 110.583 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -49.91 -43.19 42.37 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 122.106 1.871 . . . . 0.0 112.42 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.14 88.58 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.789 -1.194 . . . . 0.0 109.371 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.442 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -65.97 -45.61 81.08 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 103' ' ' MET . 44.2 tp -66.54 -53.42 35.04 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 110.415 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -56.03 -45.04 79.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.775 -1.203 . . . . 0.0 109.128 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.27 96.67 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.461 -0.775 . . . . 0.0 110.333 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.406 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.31 -35.79 78.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 108.686 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.528 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 24.3 mt -64.77 -48.04 86.14 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 CA-C-O 121.536 0.684 . . . . 0.0 109.189 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -65.71 -36.93 85.02 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.045 -1.034 . . . . 0.0 108.967 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -63.4 -32.88 85.65 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.764 HD21 ' NH1' ' A' ' 99' ' ' ARG . 10.9 p-10 -94.02 -31.52 14.2 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.886 -1.361 . . . . 0.0 110.305 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.623 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 48.3 mtp180 -64.27 144.33 57.23 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.926 -1.109 . . . . 0.0 109.948 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -68.81 154.16 42.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.587 -0.696 . . . . 0.0 110.132 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -111.17 -152.66 0.5 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.901 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.898 0 O4'-C1'-C2' 108.525 2.205 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.521 0 O4'-C1'-C2' 108.417 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O4'-C4'-C3' 107.492 1.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.446 0 O5'-C5'-C4' 113.504 2.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.995 0 O5'-C5'-C4' 113.073 2.052 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.301 0 O5'-C5'-C4' 113.427 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.796 0 O5'-C5'-C4' 112.743 1.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.541 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.202 0 O4'-C4'-C3' 107.816 2.216 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.448 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.448 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.071 0 O5'-C5'-C4' 113.365 2.261 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.448 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.018 0 O5'-C5'-C4' 113.277 2.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.874 0 O4'-C4'-C3' 107.905 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.845 0 O4'-C4'-C3' 108.0 2.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.88 0 O4'-C4'-C3' 107.733 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.207 0 O4'-C4'-C3' 107.883 2.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.784 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.871 0 O4'-C1'-C2' 108.973 2.612 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.556 0 C4'-C3'-C2' 105.645 2.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.465 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.528 2.086 0 O5'-C5'-C4' 112.913 1.938 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.322 0 C4'-C3'-C2' 105.694 2.494 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.426 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.774 0 O4'-C4'-C3' 108.082 2.482 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.421 ' C7 ' ' CD2' ' A' ' 96' ' ' LEU . . . . . . . . 0 P--O5' 1.609 1.626 0 O4'-C4'-C3' 107.763 2.163 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.007 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O5'-C5'-C4' 113.493 2.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.194 0 O5'-C5'-C4' 113.17 2.121 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O5'-C5'-C4' 113.5 2.357 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.148 0 O4'-C4'-C3' 107.694 2.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.24 0 O4'-C4'-C3' 107.828 2.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O5'-C5'-C4' 112.866 1.904 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.268 0 O4'-C4'-C3' 107.963 2.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.251 0 C1'-O4'-C4' 106.513 -2.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -115.56 80.47 1.44 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.411 -1.052 . . . . 0.0 109.276 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.84 143.81 43.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.331 -0.856 . . . . 0.0 109.635 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -55.94 -43.01 77.03 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.404 -0.81 . . . . 0.0 110.456 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.86 -40.13 94.65 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.628 -1.295 . . . . 0.0 110.2 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -59.68 -44.35 93.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.908 . . . . 0.0 111.373 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.937 ' O ' HG12 ' A' ' 13' ' ' VAL . 37.8 mt-30 -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.83 -1.169 . . . . 0.0 110.262 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -55.54 -45.96 77.17 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.927 -1.108 . . . . 0.0 109.0 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -61.32 -41.34 96.84 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.821 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -66.32 -53.22 38.93 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.42 -0.8 . . . . 0.0 111.378 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.937 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.0 p -70.04 -35.49 64.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.084 -1.01 . . . . 0.0 110.688 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HG2' HH11 ' A' ' 14' ' ' ARG . 1.1 tpt180 -62.18 -36.08 80.78 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 119.761 -1.837 . . . . 0.0 107.864 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -59.32 -32.58 70.2 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HA ' HD12 ' A' ' 19' ' ' ILE . 8.2 mt -63.03 -39.12 93.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.345 -0.847 . . . . 0.0 110.648 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -80.46 -36.31 33.71 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.565 -1.335 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' A' ' 14' ' ' ARG . 76.5 mm-40 -65.23 -30.05 70.9 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.903 -1.123 . . . . 0.0 111.024 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.687 HG21 HH12 ' A' ' 25' ' ' ARG . 15.5 mt -38.13 -39.01 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 O-C-N 121.506 -0.746 . . . . 0.0 111.061 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -170.3 163.11 8.75 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.563 -1.336 . . . . 0.0 110.785 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -90.04 67.06 6.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.775 -0.578 . . . . 0.0 110.494 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.408 ' OD1' ' C ' ' A' ' 22' ' ' ASP . 51.7 t0 -111.98 99.46 45.78 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -49.62 -47.62 22.2 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.392 2.061 . . . . 0.0 112.845 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -37.65 80.14 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.035 -1.041 . . . . 0.0 108.951 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.687 HH12 HG21 ' A' ' 19' ' ' ILE . 66.0 ttt180 -60.34 -36.82 78.85 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.263 -0.898 . . . . 0.0 109.46 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.57 -50.46 73.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.189 -0.945 . . . . 0.0 109.177 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -53.41 -36.92 62.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 109.288 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.72 -61.72 2.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.51 -0.744 . . . . 0.0 110.926 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 65.1 mt -53.75 -48.21 69.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.449 -0.782 . . . . 0.0 110.204 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 78.6 m-20 -59.83 -51.73 68.49 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.39 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -65.92 -42.15 90.48 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.966 -1.084 . . . . 0.0 109.794 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.64 -51.26 70.23 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.006 -1.059 . . . . 0.0 110.28 -178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CE2' HG23 ' A' ' 13' ' ' VAL . 46.3 m-85 -60.21 -34.59 73.86 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 118.441 -1.303 . . . . 0.0 108.01 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.6 m -67.48 -54.03 23.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.819 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -60.3 -39.48 87.1 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.178 -0.952 . . . . 0.0 109.958 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 76.4 mmm -58.72 -42.53 88.94 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.441 -0.787 . . . . 0.0 110.717 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.0 -35.53 81.49 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.892 -1.13 . . . . 0.0 109.726 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -59.0 -53.45 58.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.213 -0.929 . . . . 0.0 109.722 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.477 HH11 ' HB3' ' A' ' 108' ' ' PRO . 25.7 mtp180 -64.53 -18.04 64.47 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.503 -0.748 . . . . 0.0 111.626 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.57 5.09 60.37 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 107.817 -2.113 . . . . 0.0 107.817 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.9 p -115.62 83.74 11.58 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -87.12 146.44 7.63 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.898 2.398 . . . . 0.0 111.286 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.96 99.11 4.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 120.869 -1.144 . . . . 0.0 109.185 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.503 ' CB ' HH21 ' A' ' 45' ' ' ARG . 92.7 m-20 -64.99 -49.84 68.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.148 -0.97 . . . . 0.0 109.108 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.503 HH21 ' CB ' ' A' ' 44' ' ' ASN . 7.7 mtm180 -135.56 137.26 41.84 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.305 -0.872 . . . . 0.0 108.832 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 16' ' ' LEU . 17.9 mt -71.9 141.96 84.98 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 120.951 -1.093 . . . . 0.0 109.368 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -71.16 108.16 2.28 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 121.483 1.455 . . . . 0.0 109.785 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.597 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 49.9 mt -76.92 143.22 13.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 110.298 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.604 ' SD ' HG21 ' A' ' 97' ' ' THR . 28.8 mmm -137.55 124.63 21.54 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.09 41.08 8.47 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.027 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.6 mttp 60.5 23.03 12.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.982 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.52 ' N ' HG23 ' A' ' 48' ' ' ILE . 50.9 m -136.42 153.01 51.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.102 -0.999 . . . . 0.0 109.59 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.457 HG13 ' H ' ' A' ' 53' ' ' VAL . 1.1 m -65.94 143.57 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 108.895 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 59' ' ' LEU . 33.7 tp -75.12 122.45 23.61 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.076 -1.015 . . . . 0.0 109.554 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.04 97.16 0.08 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.423 -0.798 . . . . 0.0 109.022 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.7 mt -58.59 -27.98 65.14 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.3 -0.875 . . . . 0.0 109.138 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -80.27 -62.18 1.76 Allowed 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.863 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -55.51 -37.14 67.48 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.692 -1.255 . . . . 0.0 110.075 -178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 54' ' ' LEU . 19.4 tp -63.11 -45.2 93.15 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.433 ' CE2' HG13 ' A' ' 64' ' ' ILE . 63.4 t80 -62.16 -66.57 0.52 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 60' ' ' TYR . 50.7 t-20 -42.54 -37.7 1.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.612 -0.68 . . . . 0.0 109.355 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.878 HD22 HH22 ' A' ' 66' ' ' ARG . 11.5 mt -70.36 -48.58 55.67 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 102' ' ' TYR . 30.4 t -55.58 -42.17 67.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.256 -0.903 . . . . 0.0 110.051 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.433 HG13 ' CE2' ' A' ' 60' ' ' TYR . 10.9 mm -71.16 -33.59 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 120.795 -1.19 . . . . 0.0 107.888 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.53 -19.38 24.62 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.738 -0.785 . . . . 0.0 109.56 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.878 HH22 HD22 ' A' ' 62' ' ' LEU . 13.4 mmt-85 -96.79 -3.24 42.64 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.736 -1.228 . . . . 0.0 108.273 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 13.16 71.78 Favored Glycine 0 N--CA 1.491 2.341 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.059 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.07 131.45 2.45 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.297 -1.707 . . . . 0.0 111.714 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.733 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.6 tp -50.2 -41.21 49.19 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.589 -0.947 . . . . 0.0 109.998 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.425 HG22 ' HA ' ' A' ' 122' ' ' LEU . 80.0 t -61.49 -43.15 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.148 -0.97 . . . . 0.0 109.732 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -55.24 -38.8 68.97 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.971 -1.08 . . . . 0.0 108.862 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.637 ' O ' ' N ' ' A' ' 76' ' ' LYS . 47.0 t -64.22 -42.55 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.653 -0.654 . . . . 0.0 109.587 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.483 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 95.1 mt -65.38 -59.06 4.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.68 0 O-C-N 121.052 -1.03 . . . . 0.0 110.679 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -58.26 -40.58 82.21 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.104 -0.998 . . . . 0.0 110.4 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.7 mmtt -93.14 -12.22 30.94 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.211 -0.931 . . . . 0.0 110.855 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.637 ' N ' ' O ' ' A' ' 72' ' ' VAL . 15.1 mtmt 59.67 62.68 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.252 -0.905 . . . . 0.0 110.102 -178.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.1 14.33 24.21 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.094 -1.004 . . . . 0.0 108.627 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.523 ' NE1' HG12 ' A' ' 72' ' ' VAL . 81.8 m95 -63.44 -39.22 93.91 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.291 -0.881 . . . . 0.0 109.341 179.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.4 mm-40 -49.31 -38.29 27.12 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.651 -1.281 . . . . 0.0 108.28 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.599 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.9 mm-40 -70.53 -42.2 71.54 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.427 HG12 ' NH2' ' A' ' 66' ' ' ARG . 3.7 mt -67.34 -54.73 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' A' ' 95' ' ' ALA . 58.5 mt -53.37 -53.6 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.575 -0.703 . . . . 0.0 109.973 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -65.81 -41.31 92.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.014 -1.054 . . . . 0.0 109.627 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.48 -32.72 46.08 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.2 mt -88.93 -8.48 54.1 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.379 -1.071 . . . . 0.0 108.991 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 15.8 m80 65.32 40.8 4.64 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 109.935 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.2 mt -73.42 119.21 74.67 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.341 -0.85 . . . . 0.0 109.385 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.465 ' C ' ' H ' ' A' ' 90' ' ' SER . 52.0 Cg_exo -48.44 141.96 18.36 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 121.719 1.613 . . . . 0.0 112.229 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.8 p -59.58 -1.61 0.26 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.286 -0.884 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 88' ' ' PRO . 83.8 p -66.45 -22.9 66.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.168 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.521 HD13 ' SD ' ' A' ' 49' ' ' MET . 71.2 mt -97.78 107.48 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 120.803 -1.185 . . . . 0.0 109.46 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.5 p -78.48 -28.12 46.39 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.8 m -88.67 29.58 0.99 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.675 -0.64 . . . . 0.0 109.358 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.67 -66.64 0.46 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.508 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.8 -53.5 31.45 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.457 -0.777 . . . . 0.0 109.501 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.471 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 13.8 tp -57.36 -45.43 84.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 109.049 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.604 HG21 ' SD ' ' A' ' 49' ' ' MET . 49.6 m -60.2 -40.34 89.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.155 -0.966 . . . . 0.0 108.744 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.425 HD22 HD13 ' A' ' 59' ' ' LEU . 10.9 mt -70.8 -47.16 60.94 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.493 -0.754 . . . . 0.0 110.009 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.657 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.8 ttm180 -62.89 -51.87 65.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.003 -1.061 . . . . 0.0 111.3 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.1 m -56.7 -54.84 41.53 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.05 -1.031 . . . . 0.0 110.531 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.56 -41.87 99.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.359 -0.838 . . . . 0.0 111.264 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.867 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.5 t80 -57.88 -40.53 80.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.576 -1.328 . . . . 0.0 109.521 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.548 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -52.82 -55.32 23.88 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.415 -0.803 . . . . 0.0 110.999 -178.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -73.36 -53.37 10.93 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.874 -1.141 . . . . 0.0 112.882 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -84.6 -46.99 10.99 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -174.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.631 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.3 mp -97.45 -8.7 28.74 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.148 -1.595 . . . . 0.0 114.23 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.655 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 14.3 t80 -60.49 -38.37 56.65 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 119.725 -1.859 . . . . 0.0 109.099 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 52.5 Cg_exo -58.7 -59.74 0.44 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.578 2.186 . . . . 0.0 112.81 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -59.17 -40.86 86.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.614 -0.679 . . . . 0.0 109.518 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -69.99 -46.03 66.05 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.457 -0.777 . . . . 0.0 110.4 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ASN . 17.0 t -76.99 -45.62 26.72 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.234 -0.916 . . . . 0.0 109.912 -179.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -66.3 -49.81 65.78 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.245 -0.909 . . . . 0.0 111.266 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 28.9 mmtm -74.2 -29.34 61.7 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.971 -1.081 . . . . 0.0 111.545 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.576 ' HG2' HD21 ' A' ' 116' ' ' LEU . 19.6 tptp -125.04 -28.11 3.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.897 -1.127 . . . . 0.0 111.703 -177.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 111' ' ' CYS . 55.1 t30 56.28 47.5 19.08 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.666 -1.271 . . . . 0.0 110.619 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 114' ' ' LYS . 61.8 mt -69.02 -30.06 68.37 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.178 -0.951 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 8.1 t -154.16 -165.94 2.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.017 -1.052 . . . . 0.0 111.092 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 70.6 p -130.48 155.49 81.01 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.562 -0.711 . . . . 0.0 109.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.54 -40.09 64.08 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.862 1.708 . . . . 0.0 112.526 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.99 89.24 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.836 -1.165 . . . . 0.0 109.384 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -66.36 -42.71 87.66 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.548 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.3 tp -68.75 -51.45 41.11 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.557 -0.714 . . . . 0.0 110.212 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -58.94 -45.08 91.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.936 -1.103 . . . . 0.0 109.365 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.66 -42.46 98.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.131 -0.981 . . . . 0.0 110.327 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.91 -32.21 72.53 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 122.094 0.95 . . . . 0.0 108.728 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.488 ' HA ' ' ND2' ' A' ' 129' ' ' ASN . 4.9 mt -64.53 -51.4 68.27 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -63.72 -38.77 92.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 109.381 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -59.9 -34.02 81.13 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.657 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 7.7 p30 -93.46 -35.49 12.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.138 -1.213 . . . . 0.0 110.117 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.526 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 55.9 mtp180 -68.11 152.19 45.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.933 -1.104 . . . . 0.0 109.735 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.2 mmm180 -60.11 171.12 1.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.305 -0.872 . . . . 0.0 109.635 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -132.55 -152.76 0.51 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.56 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.997 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.004 0 O4'-C1'-C2' 108.291 1.991 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.108 0 O4'-C4'-C3' 107.9 2.3 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.496 1.896 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . 0.431 " H2'" ' H71' ' B' ' 405' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O5'-C5'-C4' 113.274 2.196 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . 0.431 ' H71' " H2'" ' B' ' 404' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.263 0 O5'-C5'-C4' 113.204 2.146 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.995 0 O5'-C5'-C4' 113.148 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 112.926 1.947 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.597 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.174 0 C4'-C3'-C2' 105.307 2.107 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O5'-C5'-C4' 113.313 2.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.397 0 O4'-C4'-C3' 107.818 2.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.059 0 O5'-C5'-C4' 113.348 2.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.932 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.803 0 O4'-C4'-C3' 107.875 2.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.681 0 O5'-C5'-C4' 112.667 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.85 0 O4'-C4'-C3' 108.019 2.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.457 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.423 -2.065 0 O4'-C1'-C2' 107.956 1.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.457 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.605 0 O5'-C5'-C4' 113.625 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.45 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.774 0 O4'-C4'-C3' 107.348 1.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.45 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.593 0 O5'-C5'-C4' 113.761 2.543 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.693 0 O4'-C4'-C3' 107.851 2.251 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.531 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.768 0 O4'-C4'-C3' 107.53 1.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.531 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O5'-C5'-C4' 113.548 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O5'-C5'-C4' 113.48 2.343 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.02 0 O4'-C1'-C2' 108.728 2.389 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.949 0 O4'-C4'-C3' 108.162 2.562 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.972 0 O4'-C4'-C3' 107.68 2.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.536 0 O4'-C4'-C3' 107.854 2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.668 0 O4'-C4'-C3' 107.593 1.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.135 0 O4'-C4'-C3' 107.955 2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.247 0 C1'-O4'-C4' 106.487 -2.295 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.436 ' N ' ' NH2' ' A' ' 45' ' ' ARG . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.499 ' NE1' ' OE1' ' A' ' 9' ' ' GLN . 66.8 t90 -119.85 80.93 1.65 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.381 -1.07 . . . . 0.0 109.315 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.418 ' OG ' ' CG ' ' A' ' 8' ' ' GLU . 76.1 p -108.35 145.62 34.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.372 -0.83 . . . . 0.0 109.881 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -57.73 -44.69 86.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.638 -0.664 . . . . 0.0 111.247 -178.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.48 -42.72 98.56 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.735 -1.228 . . . . 0.0 110.014 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.418 ' CG ' ' OG ' ' A' ' 5' ' ' SER . 96.4 mt-10 -57.68 -44.75 86.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.139 -0.976 . . . . 0.0 110.062 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.621 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.3 mt-30 -66.71 -37.94 85.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.97 -1.081 . . . . 0.0 109.434 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -49.73 -50.52 43.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -62.58 -37.2 85.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.108 -0.995 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.43 -52.64 51.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.979 -1.075 . . . . 0.0 111.969 -178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -68.87 -33.85 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 120.824 -1.173 . . . . 0.0 110.567 -179.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -67.32 -36.4 81.4 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.053 -1.655 . . . . 0.0 108.702 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -59.16 -28.98 67.1 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 46' ' ' LEU . 10.4 mt -67.66 -42.32 82.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.398 -0.814 . . . . 0.0 111.634 -179.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.8 m-85 -76.32 -33.75 59.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.37 -1.456 . . . . 0.0 109.634 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.496 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.7 mm-40 -62.62 -31.56 72.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.025 -1.047 . . . . 0.0 110.243 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.601 HD13 ' NH2' ' A' ' 25' ' ' ARG . 32.2 mt -36.98 -40.69 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.737 -0.602 . . . . 0.0 110.312 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.24 161.37 5.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.857 -1.152 . . . . 0.0 110.256 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -92.13 73.78 5.47 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -110.93 137.51 20.88 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -71.78 -62.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.251 1.967 . . . . 0.0 112.643 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -58.0 -33.64 69.15 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.056 -1.027 . . . . 0.0 109.276 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.601 ' NH2' HD13 ' A' ' 19' ' ' ILE . 58.0 ttt180 -61.87 -41.08 97.44 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.862 -1.149 . . . . 0.0 109.994 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -59.8 -59.57 5.22 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.016 -1.052 . . . . 0.0 109.883 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 7.8 pt-20 -53.15 -29.85 33.72 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.551 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -64.55 -61.98 1.87 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.06 . . . . 0.0 109.996 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 16' ' ' LEU . 55.1 mt -53.63 -45.88 70.28 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.349 -0.844 . . . . 0.0 109.557 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -65.56 -49.52 68.57 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.519 -179.696 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.599 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 57.2 t0 -64.87 -39.85 94.19 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.189 -0.945 . . . . 0.0 109.001 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.7 tp -60.76 -49.7 76.44 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.155 -1.018 . . . . 0.0 109.058 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.618 ' CE1' HD12 ' A' ' 43' ' ' ILE . 47.7 m-85 -61.55 -35.3 77.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.6 t -68.08 -54.49 17.82 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.523 -0.735 . . . . 0.0 109.576 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.91 -40.85 85.76 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.227 -0.92 . . . . 0.0 109.722 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.418 ' CE ' ' O ' ' A' ' 41' ' ' THR . 75.2 mmm -60.36 -38.15 82.94 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.577 -0.702 . . . . 0.0 110.013 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -61.85 -39.19 90.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.125 -0.985 . . . . 0.0 109.375 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -64.43 -50.53 67.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.923 . . . . 0.0 111.292 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.463 ' HE ' ' HB2' ' A' ' 108' ' ' PRO . 0.9 OUTLIER -63.69 -18.84 64.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.931 -1.106 . . . . 0.0 111.421 -177.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 4.18 61.36 Favored Glycine 0 N--CA 1.482 1.736 0 N-CA-C 107.746 -2.142 . . . . 0.0 107.746 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.418 ' O ' ' CE ' ' A' ' 36' ' ' MET . 19.4 p -114.62 83.38 8.85 Favored Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.37 151.38 13.56 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.729 2.286 . . . . 0.0 111.235 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.618 HD12 ' CE1' ' A' ' 33' ' ' PHE . 18.3 mt -89.11 103.46 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 110.724 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 64.7 m-20 -63.54 -74.51 0.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' NH2' ' N ' ' A' ' 3' ' ' GLY . 7.2 mtt180 -116.56 135.26 53.96 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.552 HD22 HD11 ' A' ' 16' ' ' LEU . 5.6 mt -69.15 144.43 95.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.224 -179.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -65.82 134.88 39.2 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 121.2 1.267 . . . . 0.0 108.974 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.532 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.1 mt -102.37 145.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.024 -1.048 . . . . 0.0 110.242 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 75.6 mtp -142.73 119.3 11.04 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 71.8 39.13 0.88 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.4 mttm 59.77 24.27 13.21 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.242 0.544 . . . . 0.0 109.79 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.8 159.42 42.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.376 -0.827 . . . . 0.0 109.267 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 148.19 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.001 -1.062 . . . . 0.0 109.738 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.597 HD13 ' SD ' ' A' ' 49' ' ' MET . 63.6 tp -76.17 121.23 22.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.508 -0.745 . . . . 0.0 109.668 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.417 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.8 m-20 -65.04 93.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.378 -0.826 . . . . 0.0 109.162 -179.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.9 mt -56.15 -25.22 45.52 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.287 -0.883 . . . . 0.0 109.341 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -81.32 -58.74 2.91 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.2 -0.938 . . . . 0.0 111.759 -179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.37 -36.81 71.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.417 -1.427 . . . . 0.0 109.257 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.551 HD22 HD21 ' A' ' 54' ' ' LEU . 53.0 tp -61.63 -47.48 85.22 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.452 ' O ' ' C ' ' A' ' 61' ' ' ASN . 56.2 t80 -58.81 -70.09 0.16 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 60' ' ' TYR . 63.2 t30 -40.48 -39.31 0.99 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.443 -0.786 . . . . 0.0 109.708 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.521 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 6.1 mt -67.6 -50.73 56.83 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.815 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -57.01 -42.41 79.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.696 -0.628 . . . . 0.0 110.256 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.494 HG23 HD11 ' A' ' 116' ' ' LEU . 5.2 mm -70.15 -29.03 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 62' ' ' LEU . . . -56.21 -29.49 61.03 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.547 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.687 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.1 mmt180 -91.61 -4.41 55.31 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.612 -1.305 . . . . 0.0 108.78 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.66 19.63 59.61 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.332 177.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.42 130.31 2.47 Favored Glycine 0 N--CA 1.498 2.811 0 O-C-N 120.28 -1.718 . . . . 0.0 111.475 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.569 HD11 ' HH2' ' A' ' 78' ' ' TRP . 10.7 tp -50.44 -39.76 48.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.584 -0.951 . . . . 0.0 110.464 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 122' ' ' LEU . 60.1 t -57.02 -43.36 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.006 -1.059 . . . . 0.0 109.691 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -57.68 -39.38 77.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.863 -1.148 . . . . 0.0 109.448 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.6 t -62.38 -42.24 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.365 -0.834 . . . . 0.0 109.516 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.8 mt -66.41 -55.66 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 120.851 -1.156 . . . . 0.0 110.692 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -57.17 -42.0 80.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.02 -1.05 . . . . 0.0 110.351 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -94.58 -8.74 37.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.254 -0.904 . . . . 0.0 110.596 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.618 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.9 mttp 57.3 59.11 3.5 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.291 -0.881 . . . . 0.0 109.513 -177.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -88.29 12.89 12.8 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.011 -1.076 . . . . 0.0 108.77 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.569 ' HH2' HD11 ' A' ' 69' ' ' LEU . 71.3 m95 -63.24 -41.04 99.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.16 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' TRP . 15.5 mm100 -49.37 -38.7 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.292 -1.505 . . . . 0.0 108.53 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.687 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.7 mm-40 -71.32 -45.87 61.98 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 108.896 178.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.448 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.8 mt -64.69 -51.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.625 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.9 mt -52.35 -54.75 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -66.64 -40.93 88.92 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.138 -0.976 . . . . 0.0 109.555 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.44 -32.29 37.66 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.4 mt -89.84 -7.88 53.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.402 -1.058 . . . . 0.0 108.801 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 64.66 42.06 4.94 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.604 -0.685 . . . . 0.0 110.618 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.5 mt -74.42 142.54 78.23 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.081 -1.012 . . . . 0.0 109.224 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 51.7 Cg_endo -72.13 142.16 37.52 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.158 1.906 . . . . 0.0 112.163 179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.1 t -56.49 0.99 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 109.761 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 19.4 m -65.8 -31.35 72.28 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.107 -0.995 . . . . 0.0 109.838 -178.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.625 HD11 ' H ' ' A' ' 50' ' ' ALA . 83.2 mt -93.93 98.26 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 120.822 -1.174 . . . . 0.0 109.486 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.9 p -69.84 -27.94 65.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 108.735 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.9 m -91.23 32.67 1.02 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.519 -0.738 . . . . 0.0 109.164 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.37 -65.52 0.68 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.09 -1.006 . . . . 0.0 108.727 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.625 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.77 -52.05 34.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 109.216 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.49 ' CD2' ' H73' ' C' ' 421' ' ' ' DT' . 5.8 tp -58.53 -43.51 89.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.861 -1.149 . . . . 0.0 109.055 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.6 m -60.56 -39.9 89.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.058 -1.026 . . . . 0.0 108.642 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.458 HD22 HD13 ' A' ' 59' ' ' LEU . 10.4 mt -70.2 -46.72 63.99 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.594 -0.691 . . . . 0.0 110.304 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.645 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 36.9 ttm180 -66.63 -50.92 61.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.066 . . . . 0.0 111.004 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.1 m -55.88 -50.99 69.13 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.967 -1.093 . . . . 0.0 109.026 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -64.31 -43.67 93.99 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.093 -1.005 . . . . 0.0 111.503 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.75 -41.01 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.274 -1.516 . . . . 0.0 108.859 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.908 ' SD ' HD21 ' A' ' 122' ' ' LEU . 42.9 mmm -51.97 -59.49 4.28 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.677 -0.639 . . . . 0.0 111.357 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -50.38 21.37 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.543 -1.348 . . . . 0.0 113.196 -177.372 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 106' ' ' LEU . 57.6 m-85 -82.0 -47.0 13.19 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -174.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.65 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.3 mp -104.28 6.19 35.2 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.394 -1.441 . . . . 0.0 114.044 -176.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.507 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 48.1 t80 -65.05 -40.29 44.56 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 119.892 -1.755 . . . . 0.0 111.475 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 83.5 Cg_endo -77.79 -40.98 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 121.687 1.591 . . . . 0.0 113.317 -179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.59 -43.52 89.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.884 -1.135 . . . . 0.0 108.109 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -68.27 -54.61 16.36 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.517 -0.739 . . . . 0.0 109.932 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' A' ' 115' ' ' ASN . 91.8 m -70.62 -43.15 69.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.866 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.475 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 40.0 tp10 -67.09 -49.5 64.82 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.715 -1.24 . . . . 0.0 110.83 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -76.18 -27.28 56.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.044 -1.035 . . . . 0.0 111.036 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HG2' HD21 ' A' ' 116' ' ' LEU . 43.6 tptt -125.12 -27.3 3.55 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.974 -1.079 . . . . 0.0 111.954 -177.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.568 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.4 t30 58.72 45.23 16.05 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.523 -1.361 . . . . 0.0 110.376 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.494 HD11 HG23 ' A' ' 64' ' ' ILE . 87.4 mt -67.82 -32.0 72.25 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.037 -1.04 . . . . 0.0 110.871 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.47 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 26.0 t -153.23 -167.71 2.8 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 119.009 -1.076 . . . . 0.0 111.292 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 81.2 p -124.5 161.61 47.14 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.605 -0.684 . . . . 0.0 110.137 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.507 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 23.3 Cg_exo -59.83 -40.97 58.53 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.602 1.535 . . . . 0.0 112.36 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.77 -37.11 86.15 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.143 -0.973 . . . . 0.0 109.871 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.47 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.69 -46.19 73.01 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.908 HD21 ' SD ' ' A' ' 103' ' ' MET . 11.4 tp -66.47 -52.08 49.96 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.485 -0.759 . . . . 0.0 109.879 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.25 -45.84 87.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.129 -0.982 . . . . 0.0 109.629 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.41 87.78 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.25 -0.906 . . . . 0.0 109.873 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.33 -33.33 74.11 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.231 -0.918 . . . . 0.0 108.907 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.595 HD11 ' SD ' ' A' ' 103' ' ' MET . 8.0 mt -65.44 -48.96 81.05 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -64.0 -38.72 92.1 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.446 -0.784 . . . . 0.0 109.138 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.5 -34.08 84.17 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.645 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 9.8 p30 -95.14 -35.19 11.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.122 -1.222 . . . . 0.0 110.598 -179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.537 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 53.7 mtp180 -68.88 156.54 38.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.75 -1.218 . . . . 0.0 109.69 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.504 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.4 mpt_? -58.98 150.32 24.86 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -106.22 125.97 51.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.399 -0.813 . . . . 0.0 109.216 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.869 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.44 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.427 -1.691 0 O4'-C1'-C2' 107.791 1.537 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.575 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O4'-C1'-C2' 108.66 2.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C4'-C3' 107.38 1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.84 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 O5'-C5'-C4' 113.148 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . 0.407 ' C5 ' ' C4 ' ' B' ' 407' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.332 0 O5'-C5'-C4' 112.949 1.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . 0.407 ' C4 ' ' C5 ' ' B' ' 406' ' ' ' DA' . . . . . . . . 0 P--O5' 1.614 2.108 0 O5'-C5'-C4' 113.104 2.074 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.532 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.31 0 O4'-C1'-C2' 108.564 2.24 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . 0.492 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.294 0 O5'-C5'-C4' 113.052 2.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.406 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O5'-C5'-C4' 113.441 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.406 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.754 0 O5'-C5'-C4' 113.176 2.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.798 0 O5'-C5'-C4' 113.804 2.574 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.7 0 O4'-C4'-C3' 107.971 2.371 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.744 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.855 0 O4'-C4'-C3' 108.03 2.43 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.835 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.911 0 O4'-C1'-C2' 109.041 2.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.176 0 O4'-C4'-C3' 108.018 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.405 ' C2 ' ' C2 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O5'-C5'-C4' 112.808 1.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.405 ' C2 ' ' C2 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.761 0 O5'-C5'-C4' 113.9 2.643 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.758 2.158 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.599 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.24 0 O5'-C5'-C4' 113.473 2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.599 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.128 0 O5'-C5'-C4' 113.473 2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . 0.492 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.979 0 O5'-C5'-C4' 113.283 2.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.358 0 O4'-C1'-C2' 108.875 2.523 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.313 0 O5'-C5'-C4' 113.615 2.439 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.533 0 O4'-C4'-C3' 107.472 1.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.67 0 O4'-C4'-C3' 107.796 2.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.011 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O4'-C4'-C3' 107.819 2.219 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.027 0 O4'-C4'-C3' 107.532 1.932 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.509 ' CE3' ' OD1' ' A' ' 44' ' ' ASN . 35.7 p90 -67.37 152.96 44.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.328 -1.101 . . . . 0.0 109.385 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.5 p -103.07 141.76 35.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.328 -0.858 . . . . 0.0 109.852 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -55.99 -34.72 66.04 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.665 -0.647 . . . . 0.0 111.205 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.25 -44.83 95.66 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.735 -1.228 . . . . 0.0 109.581 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -57.43 -43.36 83.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.112 -0.992 . . . . 0.0 109.523 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.761 ' O ' HG13 ' A' ' 13' ' ' VAL . 2.0 mp0 -72.25 -38.89 68.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.277 -0.889 . . . . 0.0 109.851 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.31 -50.9 68.39 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.121 -0.987 . . . . 0.0 109.811 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -62.03 -45.08 95.17 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.09 -1.006 . . . . 0.0 109.66 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -63.71 -47.84 79.52 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.378 -0.826 . . . . 0.0 110.278 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.761 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -72.78 -36.46 52.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 O-C-N 120.644 -1.285 . . . . 0.0 108.567 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.43 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -56.93 -40.16 75.85 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.492 -1.38 . . . . 0.0 107.761 178.363 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -58.79 -30.47 67.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.431 -0.908 . . . . 0.0 108.607 178.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.459 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.1 mt -71.72 -39.18 70.31 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.415 -0.803 . . . . 0.0 111.661 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -76.47 -32.83 58.61 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.402 -1.436 . . . . 0.0 110.29 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.467 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -66.52 -25.85 66.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.899 -1.126 . . . . 0.0 110.386 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 HH21 ' A' ' 25' ' ' ARG . 30.3 mt -38.96 -39.72 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 O-C-N 121.605 -0.684 . . . . 0.0 110.397 -179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.2 m120 -171.33 161.84 6.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.739 -1.226 . . . . 0.0 110.315 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -90.5 65.16 6.02 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.47 0.653 . . . . 0.0 109.3 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -111.9 103.22 55.04 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.502 -0.749 . . . . 0.0 109.136 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -47.83 -43.47 29.2 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.015 1.81 . . . . 0.0 111.957 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -61.62 -38.48 87.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.19 -0.944 . . . . 0.0 108.535 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.679 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -60.36 -44.53 95.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.5 -0.75 . . . . 0.0 109.389 179.89 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.3 -53.54 53.59 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 0.0 109.77 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -52.74 -39.05 61.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.432 -0.793 . . . . 0.0 109.175 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -61.12 -63.01 1.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.325 -0.859 . . . . 0.0 109.858 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.585 HD11 ' NH1' ' A' ' 25' ' ' ARG . 43.7 mt -56.2 -44.72 79.75 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.585 -0.697 . . . . 0.0 109.521 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -61.93 -46.53 88.94 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.704 -0.798 . . . . 0.0 109.121 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -66.59 -42.91 86.21 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.7 tp -61.07 -49.3 77.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 0.0 110.658 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -60.43 -36.44 78.19 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.284 -1.51 . . . . 0.0 107.528 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.3 t -69.93 -53.27 18.64 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.508 -0.745 . . . . 0.0 109.478 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 76.6 t80 -58.73 -42.38 88.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 111.17 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.446 ' CE ' ' O ' ' A' ' 41' ' ' THR . 63.4 mmm -56.49 -38.2 71.41 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.142 -0.974 . . . . 0.0 110.915 -178.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -55.68 -40.18 71.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.765 -1.209 . . . . 0.0 108.499 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -64.91 -39.54 93.67 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.884 0.85 . . . . 0.0 108.739 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.406 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 21.8 mmm180 -64.31 -30.52 71.57 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.522 -0.736 . . . . 0.0 109.265 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.26 -0.83 60.3 Favored Glycine 0 N--CA 1.485 1.948 0 N-CA-C 108.152 -1.979 . . . . 0.0 108.152 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.446 ' O ' ' CE ' ' A' ' 36' ' ' MET . 44.9 p -120.27 84.37 34.44 Favored Pre-proline 0 N--CA 1.488 1.445 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.76 141.93 11.1 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.439 2.093 . . . . 0.0 110.915 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.4 mt -78.8 101.23 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 120.928 -1.107 . . . . 0.0 110.159 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.509 ' OD1' ' CE3' ' A' ' 4' ' ' TRP . 3.1 m120 -82.91 -4.09 57.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.626 ' NE ' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -170.4 124.45 0.71 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.583 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.43 HD22 HD11 ' A' ' 16' ' ' LEU . 2.3 mt -73.09 147.56 88.3 Favored Pre-proline 0 C--N 1.291 -1.971 0 O-C-N 121.412 -0.805 . . . . 0.0 109.243 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -73.78 133.45 18.57 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.526 1.484 . . . . 0.0 108.999 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.603 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 42.2 mt -101.0 142.51 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.777 -1.202 . . . . 0.0 110.509 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.744 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.0 mtp -135.07 121.69 20.72 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.585 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.48 41.42 3.2 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -178.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 56.94 22.84 7.58 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.369 0.604 . . . . 0.0 109.681 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -132.79 148.44 52.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.399 -0.813 . . . . 0.0 109.14 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 10.2 m -67.0 145.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.895 -1.128 . . . . 0.0 108.955 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.744 HD13 ' SD ' ' A' ' 49' ' ' MET . 36.9 tp -77.11 122.57 25.17 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.307 -0.871 . . . . 0.0 109.795 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -65.84 90.96 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.525 -0.735 . . . . 0.0 109.565 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.3 -24.33 28.08 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 120.877 -1.139 . . . . 0.0 109.438 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.742 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 43.6 t80 -77.98 -59.35 2.82 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.227 -0.92 . . . . 0.0 111.654 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -60.22 -38.36 83.15 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.834 -1.166 . . . . 0.0 110.615 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.499 HD13 HD22 ' A' ' 98' ' ' LEU . 32.1 tp -58.5 -45.03 89.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 43.7 t80 -57.04 -68.43 0.23 Allowed 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.742 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 7.9 m-20 -39.91 -42.21 1.3 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.613 -0.679 . . . . 0.0 111.142 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.609 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.7 mt -69.47 -44.31 71.44 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.116 -1.433 . . . . 0.0 107.314 179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.811 HG21 ' CE2' ' A' ' 102' ' ' TYR . 34.8 t -58.43 -44.04 87.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 121.261 -0.9 . . . . 0.0 110.288 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.545 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 1.2 mm -69.42 -34.11 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.386 -1.446 . . . . 0.0 107.986 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.11 28.02 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 120.096 -0.641 . . . . 0.0 109.562 -178.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.632 HH21 ' CB ' ' A' ' 80' ' ' GLU . 7.5 mmt-85 -92.95 -4.39 52.81 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.678 -1.264 . . . . 0.0 108.898 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 19.05 62.63 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.058 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.23 128.17 2.19 Favored Glycine 0 N--CA 1.5 2.942 0 O-C-N 120.342 -1.681 . . . . 0.0 111.815 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 102' ' ' TYR . 8.1 tp -48.93 -39.34 25.87 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.601 -0.941 . . . . 0.0 109.723 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' A' ' 122' ' ' LEU . 92.8 t -58.82 -43.11 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 109.805 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -56.01 -40.78 73.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.0 109.208 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 48.0 t -60.97 -43.95 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.392 -0.818 . . . . 0.0 109.216 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 88.4 mt -66.57 -56.36 14.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 O-C-N 121.043 -1.036 . . . . 0.0 110.572 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.75 -42.83 79.98 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.991 -1.068 . . . . 0.0 110.322 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -93.28 -8.97 40.63 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.089 -1.007 . . . . 0.0 110.223 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 24.3 mtmm 57.93 60.71 2.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 0.0 109.387 -178.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.0 mt -91.2 14.76 13.39 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.466 ' CE2' HG12 ' A' ' 72' ' ' VAL . 83.0 m95 -63.73 -39.79 95.17 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.389 -0.82 . . . . 0.0 109.132 179.199 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' NE2' " H3'" ' C' ' 418' ' ' ' DA' . 77.6 mm-40 -50.49 -39.09 47.45 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.456 -1.403 . . . . 0.0 108.252 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.632 ' CB ' HH21 ' A' ' 66' ' ' ARG . 97.6 mt-10 -69.62 -43.14 73.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.45 -51.96 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 95' ' ' ALA . 85.6 mt -52.36 -51.59 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -0.884 . . . . 0.0 108.866 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.11 -41.63 85.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.198 -0.939 . . . . 0.0 109.688 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.05 -31.53 40.55 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.3 mt -89.38 -8.83 52.31 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.477 -1.014 . . . . 0.0 109.004 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 61.49 40.4 13.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -73.46 141.15 79.7 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.8 Cg_endo -67.48 138.37 45.81 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 121.884 1.723 . . . . 0.0 112.155 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.7 t -56.1 -0.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.297 -0.877 . . . . 0.0 110.035 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 16.0 m -64.87 -30.82 71.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 109.718 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.585 HD11 ' H ' ' A' ' 50' ' ' ALA . 68.7 mt -93.22 101.32 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.923 -1.111 . . . . 0.0 109.406 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -72.79 -28.02 62.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.076 -1.015 . . . . 0.0 108.662 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.4 m -89.56 30.05 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.409 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -60.06 -65.35 0.69 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.761 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.59 -52.62 29.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.451 -0.78 . . . . 0.0 109.607 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.51 HD22 ' C7 ' ' C' ' 421' ' ' ' DT' . 6.0 tp -58.79 -43.99 90.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.872 -1.142 . . . . 0.0 109.304 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 m -60.17 -38.63 83.79 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.097 -1.002 . . . . 0.0 108.597 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.499 HD22 HD13 ' A' ' 59' ' ' LEU . 9.8 mt -70.8 -46.5 62.72 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.614 -0.678 . . . . 0.0 109.85 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.682 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -65.87 -51.35 59.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 111.179 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.5 m -55.94 -53.39 57.39 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 110.108 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -63.09 -41.14 99.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.171 -0.956 . . . . 0.0 111.273 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.811 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.8 t80 -57.03 -41.44 78.62 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.112 -1.617 . . . . 0.0 109.447 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.608 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -55.94 -55.54 31.4 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.387 -0.82 . . . . 0.0 112.157 -178.612 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -70.94 -53.27 15.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 120.84 -1.163 . . . . 0.0 112.702 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.483 ' C ' HD12 ' A' ' 106' ' ' LEU . 55.7 m-85 -84.31 -44.6 13.67 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -175.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.1 mp -102.96 6.4 38.89 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.36 -1.463 . . . . 0.0 113.913 -176.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.576 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 49.0 t80 -62.42 -42.79 82.14 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 119.855 -1.778 . . . . 0.0 111.625 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 112' ' ' GLU . 95.4 Cg_endo -76.96 -41.87 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 121.473 1.448 . . . . 0.0 112.823 -178.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -57.32 -38.97 74.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.82 -1.175 . . . . 0.0 107.981 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.491 ' O ' ' OE1' ' A' ' 110' ' ' GLU . 4.7 tp10 -73.5 -54.8 7.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.608 -0.682 . . . . 0.0 110.282 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.577 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.1 m -73.02 -41.42 64.26 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.318 -0.864 . . . . 0.0 111.16 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.64 -44.8 80.99 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.706 -1.246 . . . . 0.0 110.587 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -74.66 -33.63 62.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.195 -0.941 . . . . 0.0 111.253 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HG2' HD21 ' A' ' 116' ' ' LEU . 4.1 tppt? -125.18 -24.37 4.01 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.938 -1.101 . . . . 0.0 111.773 -177.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 111' ' ' CYS . 17.3 t-20 57.01 44.94 21.97 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.631 -1.293 . . . . 0.0 110.23 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.6 mt -67.5 -29.62 69.09 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.089 -1.007 . . . . 0.0 110.828 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 118' ' ' THR . 46.5 t -152.66 -169.0 3.21 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.355 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.431 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.4 p -128.84 166.79 22.44 Favored Pre-proline 0 N--CA 1.498 1.974 0 O-C-N 121.593 -0.692 . . . . 0.0 109.61 -178.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -62.88 -40.4 35.54 Favored 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 121.382 1.388 . . . . 0.0 111.908 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.53 87.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.064 -1.023 . . . . 0.0 109.306 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.46 -45.63 79.08 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 178.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.608 HD21 ' HG3' ' A' ' 103' ' ' MET . 29.3 tp -66.17 -51.03 61.73 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.352 -0.842 . . . . 0.0 109.972 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -57.26 -46.99 82.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.081 -1.012 . . . . 0.0 109.647 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.498 ' O ' ' OD1' ' A' ' 127' ' ' ASP . . . -61.1 -41.02 95.91 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.299 -0.876 . . . . 0.0 110.082 -179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.63 -34.36 75.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 108.417 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.505 ' HA ' ' ND2' ' A' ' 129' ' ' ASN . 10.5 mt -63.94 -49.99 79.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.677 ' OD1' ' N ' ' A' ' 128' ' ' GLY . 18.9 p30 -65.75 -32.58 74.21 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 118.863 -1.135 . . . . 0.0 108.588 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.677 ' N ' ' OD1' ' A' ' 127' ' ' ASP . . . -65.61 -30.23 76.92 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.682 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 3.3 p30 -90.69 -35.99 14.6 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.004 -1.291 . . . . 0.0 110.741 -179.082 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.495 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 72.6 mtm180 -62.2 145.81 52.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.783 -1.198 . . . . 0.0 109.266 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.4 mpt_? -67.51 142.01 56.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.352 -0.843 . . . . 0.0 109.736 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -65.21 -22.44 66.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.446 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.963 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.43 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.425 -1.917 0 O4'-C1'-C2' 108.004 1.731 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.445 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C1'-C2' 108.506 2.187 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.937 0 O4'-C4'-C3' 107.429 1.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.438 0 O5'-C5'-C4' 113.377 2.269 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.991 0 O5'-C5'-C4' 113.134 2.095 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O5'-C5'-C4' 113.135 2.096 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . 0.558 ' P ' HH11 ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.693 0 O5'-C5'-C4' 112.87 1.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.603 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.431 -1.331 0 O4'-C4'-C3' 107.927 2.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.179 2.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.418 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 P--O5' 1.614 2.079 0 O4'-C1'-C2' 108.622 2.293 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.418 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.004 0 O5'-C5'-C4' 112.979 1.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.898 0 O4'-C4'-C3' 107.833 2.233 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.883 0 O4'-C4'-C3' 107.825 2.225 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.789 0 O4'-C4'-C3' 107.455 1.855 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.981 2.381 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.45 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.267 0 O4'-C1'-C2' 107.676 1.433 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . 0.45 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C4'-C3' 108.097 2.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.409 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.318 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.345 0 O5'-C5'-C4' 113.529 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.831 0 O4'-C4'-C3' 107.839 2.239 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.51 ' C7 ' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O5'-C5'-C4' 113.145 2.104 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.208 0 O5'-C5'-C4' 113.497 2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.046 0 O5'-C5'-C4' 113.287 2.205 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.162 0 O4'-C1'-C2' 108.67 2.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.168 0 O4'-C4'-C3' 108.088 2.488 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O4'-C4'-C3' 107.657 2.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.365 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.952 0 O4'-C4'-C3' 107.746 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.933 0 O4'-C4'-C3' 107.746 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.972 0 O4'-C4'-C3' 107.531 1.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.582 ' NE1' ' OE1' ' A' ' 9' ' ' GLN . 44.1 p90 -149.96 167.54 26.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 108.919 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.24 135.99 42.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.038 -1.039 . . . . 0.0 110.063 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -54.94 -34.41 63.2 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.606 -0.684 . . . . 0.0 109.829 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.37 -44.21 95.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.873 -1.142 . . . . 0.0 108.971 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -57.14 -45.48 83.51 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.215 -0.928 . . . . 0.0 109.027 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.86 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.9 mt-30 -70.52 -36.82 73.96 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.118 -0.989 . . . . 0.0 109.09 178.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -48.24 -47.27 35.93 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.476 -0.765 . . . . 0.0 109.606 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -62.14 -41.85 98.67 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.162 -0.961 . . . . 0.0 108.687 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.78 -52.95 38.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.683 -0.635 . . . . 0.0 111.454 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.86 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.9 OUTLIER -71.47 -37.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.989 -1.069 . . . . 0.0 109.959 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.405 ' HB2' ' HE ' ' A' ' 14' ' ' ARG . 6.1 tpp180 -60.19 -39.5 86.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.083 -1.636 . . . . 0.0 108.214 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -58.3 -30.71 66.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.598 HD13 HD22 ' A' ' 29' ' ' LEU . 10.9 mt -68.08 -39.46 82.92 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.457 -0.777 . . . . 0.0 111.529 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 90.8 m-85 -77.52 -37.67 50.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.357 -1.464 . . . . 0.0 110.289 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.488 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.1 -27.82 69.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.119 -0.988 . . . . 0.0 111.132 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.644 HD13 ' NH2' ' A' ' 25' ' ' ARG . 16.5 mt -36.1 -40.18 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.592 -0.693 . . . . 0.0 110.578 -178.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.402 HD22 HH11 ' A' ' 25' ' ' ARG . 50.2 p30 -172.69 167.74 5.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.836 -1.165 . . . . 0.0 110.356 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 53.6 p30 -90.53 65.39 6.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.575 -0.703 . . . . 0.0 110.707 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.89 136.01 19.6 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.955 . . . . 0.0 108.46 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.503 ' O ' ' OE1' ' A' ' 27' ' ' GLU . 67.4 Cg_endo -75.72 -62.61 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.049 1.833 . . . . 0.0 112.656 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -55.02 -36.82 65.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.416 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.644 ' NH2' HD13 ' A' ' 19' ' ' ILE . 57.9 ttt180 -57.31 -38.42 73.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.221 -0.924 . . . . 0.0 109.765 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -60.12 -58.48 8.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.963 . . . . 0.0 109.763 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.503 ' OE1' ' O ' ' A' ' 23' ' ' PRO . 44.2 mp0 -53.4 -33.65 54.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.321 -0.862 . . . . 0.0 109.995 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -60.96 -63.19 1.38 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.155 -0.965 . . . . 0.0 110.896 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.598 HD22 HD13 ' A' ' 16' ' ' LEU . 28.1 mt -56.17 -45.44 79.72 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.037 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 38.4 m-20 -62.41 -46.21 89.62 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.599 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.95 -44.39 80.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.223 -0.923 . . . . 0.0 109.782 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.2 tp -56.51 -47.88 78.41 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 110.267 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.468 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.3 m-85 -61.23 -34.74 75.6 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.311 -1.356 . . . . 0.0 108.385 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 m -69.25 -55.13 11.43 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.274 -0.891 . . . . 0.0 110.457 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 43.0 t80 -60.36 -37.2 79.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.869 . . . . 0.0 110.921 -179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.5 mmm -59.44 -37.61 78.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.17 -0.956 . . . . 0.0 110.867 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -62.93 -39.76 95.56 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.962 -1.086 . . . . 0.0 110.82 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -63.39 -36.99 85.53 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.655 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -65.03 -29.04 69.91 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.386 -179.286 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.71 -1.76 63.97 Favored Glycine 0 C--N 1.295 -1.717 0 N-CA-C 107.44 -2.264 . . . . 0.0 107.44 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.4 p -116.93 84.02 15.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -86.59 143.18 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.684 2.256 . . . . 0.0 110.575 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.549 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 20.3 mt -78.73 99.44 3.09 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 120.866 -1.146 . . . . 0.0 109.389 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.481 ' HB3' HH12 ' A' ' 45' ' ' ARG . 89.7 m-20 -67.59 -38.11 83.55 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 178.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.642 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -144.28 130.56 19.72 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 178.938 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD23 HG21 ' A' ' 43' ' ' ILE . 7.3 mt -71.46 147.61 92.72 Favored Pre-proline 0 C--N 1.298 -1.647 0 O-C-N 121.287 -0.883 . . . . 0.0 109.504 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.41 138.69 33.25 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 121.685 1.59 . . . . 0.0 109.429 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.586 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 41.3 mt -104.41 143.14 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.044 -1.035 . . . . 0.0 110.379 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.618 ' SD ' HG21 ' A' ' 97' ' ' THR . 76.7 mmm -135.35 127.3 29.56 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.58 42.47 17.29 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.2 mttt 59.72 25.62 14.62 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.415 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.501 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.35 154.71 48.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.1 -1.0 . . . . 0.0 109.794 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.7 m -67.16 144.24 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 120.939 -1.101 . . . . 0.0 109.263 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.509 HD21 HD22 ' A' ' 59' ' ' LEU . 60.1 tp -77.59 123.95 27.29 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.533 -0.73 . . . . 0.0 109.848 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.55 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.8 m-20 -66.28 90.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.339 -0.851 . . . . 0.0 109.437 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.95 -23.03 11.68 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.053 -1.029 . . . . 0.0 109.174 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.442 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 46.5 t80 -78.91 -58.95 2.98 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.228 -0.92 . . . . 0.0 111.618 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -58.61 -36.46 74.05 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.661 -1.275 . . . . 0.0 109.898 -178.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 54' ' ' LEU . 62.0 tp -62.77 -43.0 99.94 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.444 ' CE2' HG13 ' A' ' 64' ' ' ILE . 60.7 t80 -61.16 -69.94 0.21 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.815 -0.553 . . . . 0.0 109.56 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' A' ' 57' ' ' TYR . 5.5 m120 -42.73 -37.24 1.69 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.323 -0.86 . . . . 0.0 109.732 -179.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.506 HD13 ' HA ' ' A' ' 81' ' ' ILE . 9.5 mt -67.33 -51.8 48.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.856 HG21 ' CE2' ' A' ' 102' ' ' TYR . 38.8 t -57.92 -43.99 85.72 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.702 -0.624 . . . . 0.0 109.605 179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.506 HD12 ' OE1' ' A' ' 110' ' ' GLU . 14.2 mm -69.06 -37.88 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -17.55 32.76 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 120.269 -0.573 . . . . 0.0 109.794 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.681 ' HG3' HD13 ' A' ' 77' ' ' LEU . 7.5 mpt_? -97.87 4.35 49.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.838 -1.164 . . . . 0.0 109.361 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.61 12.32 80.36 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.107 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 133.2 138.33 4.03 Favored Glycine 0 N--CA 1.504 3.202 0 O-C-N 120.512 -1.581 . . . . 0.0 111.701 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 102' ' ' TYR . 7.5 tp -50.75 -43.07 58.13 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.766 -0.844 . . . . 0.0 111.349 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.8 t -60.03 -42.16 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 120.73 -1.231 . . . . 0.0 110.062 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -55.43 -37.98 68.38 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.012 -1.055 . . . . 0.0 109.313 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 76' ' ' LYS . 54.5 t -64.3 -43.62 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.584 -0.698 . . . . 0.0 109.936 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.5 mt -66.34 -58.2 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.854 -1.153 . . . . 0.0 110.987 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 88.7 m-20 -57.12 -41.48 79.08 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.034 -1.041 . . . . 0.0 110.344 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -93.06 -10.57 35.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.95 . . . . 0.0 110.608 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.598 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.8 mttp 59.18 60.6 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -0.825 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' A' ' 66' ' ' ARG . 13.7 mt -91.43 13.39 17.69 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.911 -1.118 . . . . 0.0 108.107 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.476 ' CE2' HG12 ' A' ' 72' ' ' VAL . 85.1 m95 -63.05 -41.32 99.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.352 -0.842 . . . . 0.0 109.398 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 30.5 mm100 -50.62 -36.7 36.52 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 118.054 -1.458 . . . . 0.0 108.112 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.0 mm-40 -71.17 -43.34 67.66 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.506 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.0 mt -67.8 -54.16 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.541 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.3 mt -53.13 -54.58 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -67.79 -40.55 83.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.174 -0.954 . . . . 0.0 109.32 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.38 -32.22 44.5 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.6 mt -89.57 -7.73 54.22 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.469 -1.018 . . . . 0.0 108.631 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.8 m80 65.12 40.8 4.85 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.308 0.575 . . . . 0.0 110.097 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 30.1 mt -72.47 148.77 90.81 Favored Pre-proline 0 N--CA 1.489 1.477 0 O-C-N 121.219 -0.926 . . . . 0.0 108.955 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.49 164.61 33.62 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.328 2.019 . . . . 0.0 112.129 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.8 m -82.66 -0.03 45.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.0 108.855 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 m -65.49 -33.4 75.83 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.601 -0.687 . . . . 0.0 110.235 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.419 HD13 ' SD ' ' A' ' 49' ' ' MET . 89.3 mt -91.51 100.43 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.672 -1.267 . . . . 0.0 109.312 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 67.1 p -72.24 -23.32 61.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.272 -0.892 . . . . 0.0 109.139 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.0 m -101.55 40.67 1.28 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.492 -0.755 . . . . 0.0 109.156 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -63.08 1.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 108.853 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.541 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.36 -50.91 15.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.539 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.462 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 5.6 tp -58.71 -42.47 88.75 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.788 -1.195 . . . . 0.0 109.171 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.618 HG21 ' SD ' ' A' ' 49' ' ' MET . 19.7 m -62.42 -41.17 98.5 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.127 -0.983 . . . . 0.0 108.819 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.455 HD22 HD13 ' A' ' 59' ' ' LEU . 8.5 mt -69.57 -48.35 60.58 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.722 -0.611 . . . . 0.0 109.816 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.711 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -63.35 -51.08 67.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.239 -0.913 . . . . 0.0 110.974 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.5 m -55.64 -55.12 35.8 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.236 -0.915 . . . . 0.0 109.792 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -63.3 -42.02 99.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -0.887 . . . . 0.0 111.477 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.856 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -57.83 -40.94 81.21 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.278 -1.514 . . . . 0.0 109.321 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.587 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -53.01 -56.85 12.98 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.555 -0.715 . . . . 0.0 111.566 -178.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mttm -74.58 -52.65 11.22 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.871 -1.143 . . . . 0.0 113.151 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.25 -47.76 11.19 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 106' ' ' LEU . 11.2 mp -97.11 -3.2 41.61 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.169 -1.582 . . . . 0.0 113.4 -176.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 74.8 t80 -64.14 -35.77 16.72 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 119.981 -1.699 . . . . 0.0 109.876 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 25.7 Cg_exo -63.6 -55.13 0.75 Allowed 'Trans proline' 0 N--CA 1.5 1.888 0 C-N-CA 122.427 2.085 . . . . 0.0 112.545 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.82 -46.14 85.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.42 -0.8 . . . . 0.0 109.212 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.506 ' OE1' HD12 ' A' ' 64' ' ' ILE . 3.4 tp10 -66.25 -53.57 35.33 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.317 -0.864 . . . . 0.0 109.727 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.6 t -67.24 -45.38 76.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 110.353 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -67.26 -48.91 66.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.165 -0.96 . . . . 0.0 111.379 -178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -73.57 -32.45 64.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.107 -0.996 . . . . 0.0 112.246 -177.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HG2' HD21 ' A' ' 116' ' ' LEU . 2.2 tppt? -125.18 -27.54 3.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.888 -1.132 . . . . 0.0 111.854 -177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 55.59 45.47 24.77 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.742 -1.224 . . . . 0.0 110.528 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.538 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.9 mt -68.05 -28.39 67.34 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.029 -1.044 . . . . 0.0 110.943 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -152.49 -167.01 2.63 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 118.733 -1.187 . . . . 0.0 111.607 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.534 ' N ' ' OG ' ' A' ' 117' ' ' SER . 76.7 p -131.41 158.55 74.98 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.661 -0.649 . . . . 0.0 109.914 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.11 -40.4 86.01 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.671 1.581 . . . . 0.0 112.437 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.77 -38.9 92.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.782 -1.199 . . . . 0.0 109.788 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.417 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.6 mt-10 -65.09 -41.06 95.34 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.587 HD21 ' HG3' ' A' ' 103' ' ' MET . 20.2 tp -69.36 -50.34 47.18 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.684 -0.635 . . . . 0.0 110.219 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -58.35 -46.55 86.03 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.054 -1.028 . . . . 0.0 109.729 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.32 -42.34 98.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.373 -0.829 . . . . 0.0 110.408 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.12 -33.5 74.62 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.087 -1.008 . . . . 0.0 108.429 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.502 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.3 mt -64.67 -49.52 79.95 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.962 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.51 -38.22 86.57 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.78 75.82 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.711 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 29.6 p30 -94.13 -28.25 15.79 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.266 -1.137 . . . . 0.0 110.456 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.1 mtp180 -62.95 142.2 58.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.766 -1.209 . . . . 0.0 109.491 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -66.78 150.63 48.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.488 -0.758 . . . . 0.0 109.656 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -94.23 113.77 25.75 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.259 -0.9 . . . . 0.0 108.959 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.94 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O4'-C1'-C2' 108.041 1.765 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.658 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C1'-C2' 108.821 2.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.211 0 O4'-C4'-C3' 107.48 1.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.149 0 O4'-C4'-C3' 107.779 2.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.221 0 O5'-C5'-C4' 113.161 2.115 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O5'-C5'-C4' 113.053 2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.937 0 O5'-C5'-C4' 113.263 2.188 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.586 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.311 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.364 0 O5'-C5'-C4' 113.344 2.246 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . 0.429 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 P--O5' 1.615 2.195 0 O4'-C1'-C2' 108.554 2.231 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . 0.429 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O5'-C5'-C4' 113.033 2.024 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.175 0 O5'-C5'-C4' 113.359 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O4'-C4'-C3' 107.905 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 O4'-C4'-C3' 107.56 1.96 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O4'-C4'-C3' 107.902 2.302 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.811 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C1'-C2' 108.947 2.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.399 0 O4'-C1'-C2' 108.76 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.139 0 O5'-C5'-C4' 112.895 1.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.844 0 O5'-C5'-C4' 113.839 2.599 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . 0.534 ' OP1' ' NH1' ' A' ' 99' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -1.804 0 O4'-C4'-C3' 107.889 2.289 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.495 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.075 0 O4'-C4'-C3' 107.748 2.148 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.495 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.907 0 O5'-C5'-C4' 113.475 2.339 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.041 0 O5'-C5'-C4' 113.635 2.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C1'-C2' 108.911 2.555 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.08 0 O5'-C5'-C4' 113.424 2.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.215 0 O4'-C4'-C3' 107.624 2.024 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.341 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.582 1.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.13 0 O5'-C5'-C4' 113.187 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.795 0 O4'-C4'-C3' 107.465 1.865 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CZ3' ' ND2' ' A' ' 44' ' ' ASN . 41.3 p90 -65.04 152.0 44.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.353 -1.086 . . . . 0.0 109.718 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 74.2 p -103.25 145.48 29.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.309 -0.869 . . . . 0.0 109.881 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.565 ' C ' ' CD1' ' A' ' 6' ' ' PHE . 0.1 OUTLIER -55.64 -41.88 74.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.634 -0.666 . . . . 0.0 110.449 -178.243 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' N ' ' CG ' ' A' ' 6' ' ' PHE . 96.4 mt-10 -61.83 -45.42 93.9 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.003 -1.061 . . . . 0.0 109.547 -179.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.38 -41.02 96.43 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.257 -0.902 . . . . 0.0 109.566 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.908 ' O ' HG12 ' A' ' 13' ' ' VAL . 3.5 mm100 -74.46 -41.38 60.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.319 -0.863 . . . . 0.0 109.578 179.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -50.91 -47.44 60.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 0.0 109.535 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -61.36 -42.28 98.45 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.179 -0.951 . . . . 0.0 109.469 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -67.0 -51.53 53.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.179 -0.95 . . . . 0.0 111.194 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.908 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -71.74 -39.61 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.256 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -58.92 -38.9 80.02 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.099 -1.626 . . . . 0.0 108.155 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -60.71 -31.32 70.61 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.648 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.547 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.4 mt -64.55 -39.15 93.23 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 110.734 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.412 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -79.57 -34.98 40.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.561 -1.337 . . . . 0.0 109.835 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.44 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.7 mt-10 -64.8 -29.22 70.18 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.063 -1.023 . . . . 0.0 110.601 -178.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.53 HD12 ' HA ' ' A' ' 16' ' ' LEU . 16.5 mt -37.82 -39.94 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.518 -0.739 . . . . 0.0 110.897 -178.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 0.9 OUTLIER -173.02 164.97 4.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.649 -1.282 . . . . 0.0 110.677 -179.159 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -92.14 67.18 4.99 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.838 -0.539 . . . . 0.0 110.078 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.33 102.87 54.14 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.36 -48.83 14.25 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.952 1.768 . . . . 0.0 112.341 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 24' ' ' LYS . 0.9 OUTLIER -61.04 -37.1 81.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.996 -1.065 . . . . 0.0 108.919 179.421 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.642 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.2 ttt-85 -60.33 -42.89 96.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.306 -0.871 . . . . 0.0 109.439 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -62.22 -52.61 63.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.991 -1.068 . . . . 0.0 109.644 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -52.26 -35.04 48.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 0.0 109.288 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.98 -62.69 1.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.639 0.733 . . . . 0.0 110.549 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.547 HD13 ' HB3' ' A' ' 16' ' ' LEU . 14.6 mt -57.38 -43.21 83.42 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.643 -0.661 . . . . 0.0 109.365 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.412 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 96.5 m-20 -58.94 -50.75 72.88 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.211 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -66.99 -44.03 81.44 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.341 -0.85 . . . . 0.0 110.333 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.4 tp -57.96 -50.42 73.44 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.94 . . . . 0.0 110.381 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -60.85 -34.23 74.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.154 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -67.03 -54.66 19.49 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.336 -0.852 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.53 -38.98 86.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.661 -179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mmm -59.47 -39.41 83.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 111.512 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.427 ' NE2' ' HB3' ' A' ' 42' ' ' PRO . 85.2 mm-40 -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.739 -1.225 . . . . 0.0 110.783 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 52.9 mttt -64.96 -44.05 90.66 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.031 -1.043 . . . . 0.0 109.509 -179.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.47 HH11 ' HB3' ' A' ' 108' ' ' PRO . 7.8 mtp180 -63.2 -25.47 68.35 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.963 -177.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.21 0.23 55.91 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 107.977 -2.049 . . . . 0.0 107.977 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 50.1 p -115.61 83.9 11.74 Favored Pre-proline 0 N--CA 1.49 1.56 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 70.7 Cg_endo -85.08 142.73 8.86 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.647 2.232 . . . . 0.0 111.084 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.502 HG21 HD23 ' A' ' 46' ' ' LEU . 45.2 mt -78.88 94.53 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 C-N-CA 118.795 -1.162 . . . . 0.0 109.329 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.55 ' ND2' ' CZ3' ' A' ' 4' ' ' TRP . 82.1 m-20 -65.97 -32.89 74.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -151.23 133.28 15.16 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.502 HD23 HG21 ' A' ' 43' ' ' ILE . 13.1 mt -71.45 146.76 92.08 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 120.784 -1.197 . . . . 0.0 109.267 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.54 104.16 1.76 Allowed 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 121.636 1.558 . . . . 0.0 109.735 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.598 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 50.2 mt -72.7 142.4 15.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.082 -1.011 . . . . 0.0 110.202 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.815 ' SD ' HG21 ' A' ' 97' ' ' THR . 64.9 mmm -138.51 127.96 24.61 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.782 0.801 . . . . 0.0 108.972 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.522 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 63.32 40.04 8.94 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 -178.149 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 59.42 22.62 11.1 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.321 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.8 m -137.1 155.4 49.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.182 -0.949 . . . . 0.0 109.512 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 m -65.82 143.4 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.81 -1.181 . . . . 0.0 108.836 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 59' ' ' LEU . 42.1 tp -77.76 124.45 27.97 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.17 -0.956 . . . . 0.0 109.135 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -65.17 91.64 0.1 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.569 -0.707 . . . . 0.0 110.045 -178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.3 mt -53.89 -25.14 18.59 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 120.99 -1.068 . . . . 0.0 108.848 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.48 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 46.9 t80 -79.38 -57.85 3.5 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 111.685 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.13 -39.25 91.92 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.659 -1.276 . . . . 0.0 110.153 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 54' ' ' LEU . 60.7 tp -60.02 -40.98 91.15 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.829 -1.169 . . . . 0.0 108.352 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -61.56 -67.17 0.43 Allowed 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.48 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 88.0 m-20 -43.06 -39.75 2.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.482 -0.761 . . . . 0.0 111.123 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -70.21 -46.58 64.25 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 117.656 -1.618 . . . . 0.0 107.356 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.902 HG21 ' CE2' ' A' ' 102' ' ' TYR . 33.8 t -57.61 -44.49 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 110.566 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.499 HG23 HD11 ' A' ' 116' ' ' LEU . 10.9 mm -70.16 -34.2 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 120.508 -1.37 . . . . 0.0 108.007 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.18 -20.44 26.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.82 -0.55 . . . . 0.0 110.232 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.587 HH21 ' CB ' ' A' ' 80' ' ' GLU . 14.6 mmt-85 -94.53 2.07 55.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.713 -1.242 . . . . 0.0 108.732 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.97 14.4 77.37 Favored Glycine 0 N--CA 1.493 2.438 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.154 177.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.61 2.96 Favored Glycine 0 N--CA 1.501 2.974 0 O-C-N 120.519 -1.577 . . . . 0.0 111.316 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.503 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.7 tp -50.11 -40.91 47.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.65 -0.912 . . . . 0.0 110.754 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.549 HG22 ' HA ' ' A' ' 122' ' ' LEU . 76.3 t -58.99 -41.54 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.903 -1.123 . . . . 0.0 109.863 -179.02 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -56.4 -39.84 73.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.995 -1.065 . . . . 0.0 108.877 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 76' ' ' LYS . 98.2 t -64.99 -44.26 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.544 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.402 HD12 ' CD1' ' A' ' 122' ' ' LEU . 43.8 mt -67.44 -52.54 40.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.821 0 O-C-N 120.862 -1.149 . . . . 0.0 110.01 -178.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -57.73 -42.97 84.95 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.995 -1.066 . . . . 0.0 110.35 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -94.94 -8.88 35.75 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 72' ' ' VAL . 37.7 mtmt 59.04 60.69 2.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.338 -0.851 . . . . 0.0 109.703 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.413 HD13 ' HD2' ' A' ' 66' ' ' ARG . 14.7 mt -90.9 17.63 7.59 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.503 ' CH2' HD11 ' A' ' 69' ' ' LEU . 97.9 m95 -64.48 -43.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.537 179.245 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 78' ' ' TRP . 44.9 mt-30 -48.21 -38.83 19.31 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.254 -1.379 . . . . 0.0 108.35 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.587 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.0 mm-40 -66.39 -40.79 89.87 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -72.41 -52.32 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.568 HD11 ' HB2' ' A' ' 95' ' ' ALA . 45.9 mt -52.96 -52.55 27.86 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -72.3 -40.7 67.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.479 -0.763 . . . . 0.0 109.899 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.75 -34.87 45.24 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.8 mt -89.71 -7.96 53.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -1.075 . . . . 0.0 108.888 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 67.22 38.5 3.33 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.34 0.591 . . . . 0.0 109.546 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.66 120.08 78.73 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.407 -0.808 . . . . 0.0 108.967 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.481 ' C ' ' H ' ' A' ' 90' ' ' SER . 50.8 Cg_exo -47.79 139.16 19.51 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.767 1.645 . . . . 0.0 112.694 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 83.4 p -60.84 0.91 0.17 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.344 -0.848 . . . . 0.0 109.887 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.481 ' H ' ' C ' ' A' ' 88' ' ' PRO . 6.0 m -62.7 -33.04 74.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.146 -0.971 . . . . 0.0 109.503 -178.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.522 HD11 ' H ' ' A' ' 50' ' ' ALA . 85.7 mt -87.2 101.12 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.826 -1.171 . . . . 0.0 108.937 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 39.1 p -68.18 -29.31 68.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.311 -0.868 . . . . 0.0 109.132 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -94.79 39.96 1.1 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.53 -0.731 . . . . 0.0 109.067 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.77 -64.62 0.86 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.14 -0.975 . . . . 0.0 108.931 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.568 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.98 24.22 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.342 -0.849 . . . . 0.0 109.6 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.519 HD12 ' NH2' ' A' ' 99' ' ' ARG . 6.8 tp -58.61 -47.38 84.52 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.732 -1.23 . . . . 0.0 109.628 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.815 HG21 ' SD ' ' A' ' 49' ' ' MET . 58.1 m -59.51 -40.1 86.02 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.032 -1.043 . . . . 0.0 108.842 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.404 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.6 mt -71.05 -45.45 63.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.659 -0.651 . . . . 0.0 110.255 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.519 ' NH2' HD12 ' A' ' 96' ' ' LEU . 9.1 tmm_? -67.28 -50.67 59.42 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.841 -1.162 . . . . 0.0 110.952 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.3 m -55.99 -54.8 40.52 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.163 -0.961 . . . . 0.0 110.081 -178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -61.99 -40.57 96.07 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.105 -0.997 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.902 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.8 t80 -57.58 -39.82 77.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.21 -1.556 . . . . 0.0 109.402 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.572 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.7 ttm -55.58 -55.94 26.16 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.393 -0.817 . . . . 0.0 112.246 -178.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -72.85 -52.05 16.34 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.627 -1.296 . . . . 0.0 112.823 -176.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.505 ' C ' HD12 ' A' ' 106' ' ' LEU . 58.6 m-85 -83.69 -43.19 15.8 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -175.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -99.63 -7.25 26.0 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.283 -1.511 . . . . 0.0 114.238 -176.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.652 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 46.5 t80 -62.3 -36.92 31.94 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 119.686 -1.884 . . . . 0.0 109.727 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.652 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.9 Cg_exo -65.69 -56.81 0.29 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.242 1.961 . . . . 0.0 112.091 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.31 -35.93 74.7 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -71.8 -56.21 6.17 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.732 -0.605 . . . . 0.0 110.309 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.5 OUTLIER -69.96 -41.53 74.36 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.304 -0.872 . . . . 0.0 110.1 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 45.4 tp10 -66.57 -49.52 66.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.261 -0.9 . . . . 0.0 110.799 -178.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -74.67 -30.22 61.52 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.088 -1.008 . . . . 0.0 111.513 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG2' HD21 ' A' ' 116' ' ' LEU . 40.2 tptt -125.35 -27.63 3.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.004 -1.06 . . . . 0.0 112.115 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' A' ' 111' ' ' CYS . 29.9 t30 57.04 45.42 21.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.579 -1.326 . . . . 0.0 110.065 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.499 HD11 HG23 ' A' ' 64' ' ' ILE . 78.7 mt -67.55 -33.24 74.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.116 -0.99 . . . . 0.0 111.431 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.568 ' OG ' ' N ' ' A' ' 118' ' ' THR . 27.6 t -154.28 -166.11 2.27 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.598 -1.241 . . . . 0.0 111.75 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.568 ' N ' ' OG ' ' A' ' 117' ' ' SER . 81.9 p -124.67 152.24 68.88 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.888 -0.508 . . . . 0.0 109.754 -178.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.66 -38.71 91.08 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.2 1.933 . . . . 0.0 112.326 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.65 88.11 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.874 -1.141 . . . . 0.0 109.427 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -65.78 -42.09 91.2 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 103' ' ' MET . 13.0 tp -67.56 -51.72 47.24 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.686 -0.634 . . . . 0.0 109.871 178.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -56.12 -45.67 79.44 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.948 -1.095 . . . . 0.0 108.289 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.35 89.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.421 -0.799 . . . . 0.0 109.201 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.76 -36.63 80.87 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.527 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.9 mt -64.1 -48.72 84.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.424 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 58.1 t0 -62.22 -37.64 86.15 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.957 -1.09 . . . . 0.0 108.256 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.65 -33.27 84.43 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.641 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 28.1 p-10 -92.27 -31.63 15.33 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.9 -1.353 . . . . 0.0 110.424 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.641 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 81.8 mtm180 -64.24 144.48 57.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.613 -1.305 . . . . 0.0 109.418 179.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.577 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.5 mpt_? -67.93 149.04 50.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.255 -0.903 . . . . 0.0 109.657 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.35 -10.54 58.35 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.879 0.847 . . . . 0.0 109.228 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.951 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 401' ' ' ' DC' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.426 -1.777 0 O4'-C1'-C2' 107.843 1.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 402' ' ' ' DC' . . . . . 0.579 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.225 0 O4'-C1'-C2' 108.611 2.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.136 0 O4'-C4'-C3' 107.546 1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.424 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.115 0 O5'-C5'-C4' 112.962 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.096 0 O5'-C5'-C4' 113.043 2.031 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.914 0 O5'-C5'-C4' 113.33 2.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 408' ' ' ' DT' . . . . . 0.598 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.606 1.268 0 C4'-C3'-C2' 105.3 2.1 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.256 0 O5'-C5'-C4' 113.201 2.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.304 0 O5'-C5'-C4' 113.255 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.823 0 O5'-C5'-C4' 113.237 2.169 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.303 0 O5'-C5'-C4' 113.541 2.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.273 0 O4'-C4'-C3' 107.894 2.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.9 0 O4'-C4'-C3' 107.642 2.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.975 0 O4'-C4'-C3' 108.088 2.488 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 416' ' ' ' DC' . . . . . 0.816 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C1'-C2' 109.025 2.659 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.402 0 O4'-C1'-C2' 108.702 2.365 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 418' ' ' ' DA' . . . . . 0.471 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.111 0 O5'-C5'-C4' 112.859 1.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 419' ' ' ' DC' . . . . . 0.471 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.717 0 O5'-C5'-C4' 113.975 2.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.871 0 O4'-C4'-C3' 107.736 2.136 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 421' ' ' ' DT' . . . . . 0.457 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.092 0 O5'-C5'-C4' 113.059 2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 422' ' ' ' DC' . . . . . 0.457 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.101 0 O5'-C5'-C4' 113.691 2.493 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.805 0 O5'-C5'-C4' 113.49 2.35 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.187 0 O4'-C1'-C2' 108.686 2.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.32 0 O4'-C4'-C3' 108.066 2.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.135 0 O4'-C4'-C3' 107.701 2.101 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.607 1.351 0 O4'-C4'-C3' 107.741 2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.613 2.013 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.897 0 O4'-C4'-C3' 107.899 2.299 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.71 0 O4'-C4'-C3' 107.611 2.011 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.586 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 19.8 mm-40 . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.18 -49.38 74.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.952 -1.092 . . . . 0.0 109.83 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.6 mtmm -60.74 -35.63 76.84 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.035 -1.041 . . . . 0.0 108.911 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -66.35 -49.99 65.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.55 -0.719 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.28 -35.86 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 120.771 -1.206 . . . . 0.0 108.901 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.572 ' NH1' ' OE2' ' A' ' 18' ' ' GLU . 0.5 OUTLIER -54.83 -40.47 69.61 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.435 ' HA ' HE21 ' A' ' 15' ' ' GLN . 7.4 mm-40 -59.76 -31.64 69.84 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.493 ' HB3' HD13 ' A' ' 29' ' ' LEU . 13.1 mt -70.77 -37.31 73.35 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.354 -0.841 . . . . 0.0 111.129 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.3 m-85 -79.25 -33.0 43.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.487 -1.383 . . . . 0.0 110.329 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.572 ' OE2' ' NH1' ' A' ' 14' ' ' ARG . 97.8 mt-10 -66.24 -30.06 70.43 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.915 -1.115 . . . . 0.0 110.45 -178.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.679 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.9 mt -36.17 -40.39 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 O-C-N 121.719 -0.613 . . . . 0.0 110.687 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -171.68 164.6 6.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.654 -1.279 . . . . 0.0 110.766 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -90.79 65.6 5.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.748 -0.595 . . . . 0.0 110.103 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.569 ' OD1' ' N ' ' A' ' 25' ' ' ARG . 10.8 t70 -112.42 95.72 32.75 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.351 -0.843 . . . . 0.0 108.847 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.46 -41.72 35.92 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.369 2.046 . . . . 0.0 112.217 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -60.06 -41.0 91.42 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.208 -0.932 . . . . 0.0 108.486 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.679 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.4 ttt180 -61.32 -38.96 88.77 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.631 -0.668 . . . . 0.0 110.134 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -59.88 -48.89 79.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.191 -0.943 . . . . 0.0 109.41 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -53.46 -38.49 63.63 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.51 -0.744 . . . . 0.0 109.367 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -64.55 -61.25 2.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.976 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.493 HD13 ' HB3' ' A' ' 16' ' ' LEU . 49.1 mt -55.47 -46.67 76.82 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.334 -0.854 . . . . 0.0 108.781 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -62.0 -49.11 77.36 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.219 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 53.3 t0 -66.7 -42.44 86.42 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -57.89 -50.37 73.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.103 -0.998 . . . . 0.0 110.192 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 46.6 m-85 -61.19 -35.21 76.54 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 118.064 -1.454 . . . . 0.0 107.54 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.529 ' HG ' ' H ' ' A' ' 35' ' ' PHE . 32.3 p -70.76 -53.62 14.78 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.716 0.77 . . . . 0.0 109.371 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.529 ' H ' ' HG ' ' A' ' 34' ' ' SER . 43.9 t80 -57.4 -44.02 84.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.701 -0.624 . . . . 0.0 110.402 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mmm -56.71 -34.46 67.48 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.365 -0.834 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.423 ' C ' ' OE1' ' A' ' 37' ' ' GLN . 5.2 tm0? -54.43 -41.68 69.65 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.402 ' NZ ' ' CD1' ' A' ' 35' ' ' PHE . 6.6 ttpm? -67.07 -40.09 86.97 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.498 -0.751 . . . . 0.0 109.578 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.403 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.8 mmm180 -64.41 -30.76 71.8 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.811 -0.556 . . . . 0.0 109.913 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.24 0.71 65.23 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.1 p -117.17 85.25 18.46 Favored Pre-proline 0 N--CA 1.488 1.44 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -83.47 145.97 12.03 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.537 2.158 . . . . 0.0 111.281 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 15.7 mt -86.9 104.81 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 120.921 -1.112 . . . . 0.0 110.475 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.606 ' O ' ' NE ' ' A' ' 45' ' ' ARG . 79.5 m-20 -85.34 -10.26 56.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.606 ' NE ' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -156.21 117.54 3.86 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.475 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 16' ' ' LEU . 3.2 mt -70.82 138.23 85.44 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 120.463 -1.398 . . . . 0.0 108.949 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -52.76 133.93 52.36 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 N-CA-C 109.391 -1.042 . . . . 0.0 109.391 176.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.425 HG23 ' O ' ' A' ' 52' ' ' SER . 5.8 mt -105.14 149.36 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.967 -1.083 . . . . 0.0 109.775 -179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.64 ' SD ' HD13 ' A' ' 54' ' ' LEU . 22.9 mtt -142.23 120.9 12.59 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.45 41.79 7.22 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 70.9 mttt 60.45 27.13 16.74 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.322 0.582 . . . . 0.0 109.597 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.425 ' O ' HG23 ' A' ' 48' ' ' ILE . 86.6 p -137.33 154.67 50.01 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 109.417 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 m -69.31 147.22 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 109.687 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 49' ' ' MET . 57.4 tp -84.36 127.89 34.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.345 -0.847 . . . . 0.0 109.539 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.588 ' CG ' HH22 ' A' ' 25' ' ' ARG . 4.6 m-20 -66.31 90.33 0.15 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.377 -0.827 . . . . 0.0 109.575 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.7 mt -55.57 -25.27 37.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.976 -1.078 . . . . 0.0 109.601 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -76.3 -54.64 6.49 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.227 -0.921 . . . . 0.0 111.636 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.31 -37.5 83.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.778 -1.201 . . . . 0.0 109.739 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 HD22 ' A' ' 98' ' ' LEU . 53.9 tp -58.8 -44.72 90.86 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.983 -1.073 . . . . 0.0 108.278 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.44 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.6 t80 -56.73 -68.06 0.25 Allowed 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.73 -0.606 . . . . 0.0 109.848 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -42.7 -39.87 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.371 -0.831 . . . . 0.0 111.415 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.416 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 6.1 mt -71.24 -44.35 65.49 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 118.144 -1.422 . . . . 0.0 107.628 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.794 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.4 t -59.16 -46.11 92.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.282 -0.886 . . . . 0.0 109.848 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.44 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -67.98 -35.83 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.711 -1.243 . . . . 0.0 108.414 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.75 -25.82 20.53 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.985 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.611 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.6 mpt_? -91.3 -2.9 57.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.564 -1.335 . . . . 0.0 109.109 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.31 20.55 56.77 Favored Glycine 0 N--CA 1.492 2.42 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.227 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.97 132.64 3.09 Favored Glycine 0 N--CA 1.5 2.914 0 O-C-N 120.503 -1.586 . . . . 0.0 111.407 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' HH2' ' A' ' 78' ' ' TRP . 9.7 tp -49.85 -38.35 34.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.645 -0.915 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.62 HG22 ' HA ' ' A' ' 122' ' ' LEU . 70.1 t -59.15 -42.79 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.912 -1.117 . . . . 0.0 110.814 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -56.34 -39.08 72.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.776 -1.203 . . . . 0.0 109.218 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 49.5 t -63.34 -43.59 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.756 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 83.6 mt -66.04 -57.16 11.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 O-C-N 120.834 -1.166 . . . . 0.0 110.284 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' HG12 ' A' ' 70' ' ' VAL . 13.5 m120 -57.1 -42.85 81.54 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.268 -0.895 . . . . 0.0 110.28 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -94.44 -7.31 41.82 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.924 . . . . 0.0 111.292 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.6 mttm 58.8 58.33 3.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.299 -0.876 . . . . 0.0 110.589 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.0 mt -91.81 13.82 17.23 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.779 -1.2 . . . . 0.0 108.51 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.562 ' HH2' HD11 ' A' ' 69' ' ' LEU . 84.0 m95 -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.372 -0.83 . . . . 0.0 108.777 178.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.529 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 9.4 mp0 -50.15 -40.18 45.68 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 120.618 -1.302 . . . . 0.0 108.342 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.611 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.3 mt-10 -68.51 -40.59 80.77 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.083 -1.011 . . . . 0.0 108.302 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.35 -52.15 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 67.4 mt -53.07 -53.61 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.519 -0.738 . . . . 0.0 109.354 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 86' ' ' HIS . 26.1 mmtp -72.01 -39.59 69.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.0 109.888 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.63 -31.57 22.82 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.63 -6.83 51.57 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.439 -1.036 . . . . 0.0 109.127 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 83' ' ' LYS . 41.9 m-70 65.86 41.12 3.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.776 -0.578 . . . . 0.0 109.921 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' CD2' ' SD ' ' A' ' 49' ' ' MET . 12.0 mt -73.02 147.78 88.62 Favored Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.405 -0.81 . . . . 0.0 109.339 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.417 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.9 Cg_endo -73.29 141.47 32.17 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 C-N-CA 122.353 2.035 . . . . 0.0 112.368 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.7 p -62.25 -0.78 0.6 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.833 . . . . 0.0 109.987 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.417 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.0 p -65.79 -23.51 66.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.09 -1.006 . . . . 0.0 109.934 -178.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 80.2 mt -98.3 105.96 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 120.96 -1.088 . . . . 0.0 109.224 178.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 50.6 p -76.19 -25.66 55.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 109.054 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.1 m -96.05 34.64 1.53 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.546 -0.721 . . . . 0.0 109.259 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.29 -64.43 0.95 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.68 25.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.315 -0.865 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.88 -43.15 90.84 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.801 -1.187 . . . . 0.0 108.954 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.7 m -60.11 -40.14 88.63 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.085 -1.009 . . . . 0.0 108.426 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -70.55 -46.54 63.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.664 -0.647 . . . . 0.0 109.675 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.584 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.6 ttm180 -66.32 -52.09 50.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.905 -1.122 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.485 HG22 ' HE2' ' A' ' 104' ' ' LYS . 50.2 m -55.69 -54.09 48.53 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.133 -0.979 . . . . 0.0 110.228 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.555 ' OE1' ' CD2' ' A' ' 54' ' ' LEU . 1.0 OUTLIER -65.67 -43.68 88.57 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.975 -1.078 . . . . 0.0 112.012 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.794 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.5 t80 -55.68 -41.72 74.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.06 -1.65 . . . . 0.0 108.893 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.742 ' HG2' HD21 ' A' ' 122' ' ' LEU . 90.7 mtp -53.14 -50.72 63.96 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.514 -0.741 . . . . 0.0 110.621 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' A' ' 100' ' ' THR . 32.1 mttm -72.37 -53.95 10.82 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.031 -1.043 . . . . 0.0 112.875 -177.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.412 ' C ' HD12 ' A' ' 106' ' ' LEU . 27.9 m-85 -85.51 -52.63 5.71 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.1 mp -94.53 2.82 55.68 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.303 -1.498 . . . . 0.0 113.796 -175.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.635 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.1 t80 -62.98 -35.96 21.89 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 120.048 -1.657 . . . . 0.0 110.405 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.635 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 12.3 Cg_exo -68.53 -54.21 0.3 Allowed 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.13 1.887 . . . . 0.0 112.31 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.408 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 0.8 OUTLIER -56.97 -47.61 80.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.391 -0.818 . . . . 0.0 109.299 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 87.2 tt0 -68.89 -44.83 72.43 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.169 -0.957 . . . . 0.0 110.562 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.3 t -81.04 -45.97 15.74 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.977 -1.077 . . . . 0.0 111.244 -178.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 108' ' ' PRO . 44.1 tp10 -67.76 -51.7 45.9 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.634 -1.291 . . . . 0.0 111.518 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -73.72 -33.14 64.23 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.855 -1.153 . . . . 0.0 111.797 -178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HG2' HD21 ' A' ' 116' ' ' LEU . 34.1 tptt -114.55 -29.48 6.82 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.833 -1.167 . . . . 0.0 111.784 -177.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 111' ' ' CYS . 53.5 t30 57.29 44.79 21.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.6 -1.313 . . . . 0.0 110.288 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.444 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.8 mt -66.08 -30.06 70.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.223 -0.923 . . . . 0.0 110.581 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -154.47 -167.25 2.56 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.917 -178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' A' ' 117' ' ' SER . 82.1 p -129.01 159.49 68.47 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.515 -0.741 . . . . 0.0 109.672 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -55.52 -40.29 86.3 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.595 1.53 . . . . 0.0 112.207 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.29 -37.59 87.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.015 -1.053 . . . . 0.0 109.379 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.424 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.28 -46.06 74.75 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 103' ' ' MET . 17.6 tp -65.61 -53.28 43.85 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.404 -0.81 . . . . 0.0 109.942 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -56.86 -44.49 82.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.054 . . . . 0.0 108.907 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.05 85.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.114 -0.991 . . . . 0.0 109.155 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.439 ' CB ' HD21 ' A' ' 74' ' ' ASN . . . -68.28 -35.97 78.67 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.742 HD11 ' SD ' ' A' ' 103' ' ' MET . 29.4 mt -64.09 -49.82 79.72 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.14 -38.46 86.48 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.88 88.67 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.663 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.2 OUTLIER -94.05 -31.68 14.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.073 -1.251 . . . . 0.0 110.078 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.656 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.2 mtp180 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.853 -1.154 . . . . 0.0 109.607 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.3 mp0 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -48.51 -52.58 21.77 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.882 . . . . 0.0 109.81 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -61.22 -39.92 92.07 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.2 -0.938 . . . . 0.0 108.9 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.414 ' C ' HD11 ' A' ' 46' ' ' LEU . 14.3 mm100 -66.52 -49.18 67.38 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.365 -0.834 . . . . 0.0 110.798 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -70.96 -37.79 69.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 120.497 -1.377 . . . . 0.0 108.789 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -53.3 -39.21 63.83 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.592 -1.317 . . . . 0.0 107.761 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -58.93 -31.47 68.71 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.458 ' CD1' HD22 ' A' ' 46' ' ' LEU . 8.3 mt -72.48 -38.75 68.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.281 -0.887 . . . . 0.0 111.504 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -76.49 -33.24 58.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.433 -1.417 . . . . 0.0 110.314 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.479 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.5 mm-40 -66.98 -26.63 66.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.967 -1.083 . . . . 0.0 110.55 -178.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.697 HG21 HH12 ' A' ' 25' ' ' ARG . 32.2 mt -37.56 -38.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 O-C-N 121.798 -0.564 . . . . 0.0 110.487 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.72 161.62 7.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.858 -1.151 . . . . 0.0 110.323 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.7 p30 -88.99 66.52 7.88 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.539 0.685 . . . . 0.0 109.342 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -112.04 93.56 21.93 Favored Pre-proline 0 N--CA 1.489 1.503 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -47.1 -37.98 23.92 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.238 1.958 . . . . 0.0 112.004 -178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -62.77 -40.17 96.47 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.241 -0.912 . . . . 0.0 108.829 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.697 HH12 HG21 ' A' ' 19' ' ' ILE . 62.6 ttt180 -61.35 -37.08 82.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.478 -0.763 . . . . 0.0 110.454 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -60.16 -50.71 72.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.131 -0.981 . . . . 0.0 109.428 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -53.25 -38.77 63.32 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.431 -0.793 . . . . 0.0 109.677 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -62.01 -62.91 1.45 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.369 -0.832 . . . . 0.0 110.803 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 49.9 mt -55.57 -44.16 76.61 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.448 -0.782 . . . . 0.0 109.414 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.99 -48.57 81.22 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.68 -42.73 86.04 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.132 -0.98 . . . . 0.0 109.546 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.48 -53.19 60.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.29 -0.881 . . . . 0.0 110.333 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -62.3 -33.25 74.31 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 118.483 -1.287 . . . . 0.0 107.811 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -67.92 -56.59 8.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.617 -0.677 . . . . 0.0 109.663 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 49.4 t80 -60.78 -42.28 97.22 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.253 -0.904 . . . . 0.0 110.3 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.483 ' CE ' ' O ' ' A' ' 41' ' ' THR . 73.7 mmm -59.17 -40.54 85.92 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.534 -0.729 . . . . 0.0 110.912 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -60.44 -41.57 94.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.954 -1.092 . . . . 0.0 109.72 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -61.9 -47.44 84.95 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.576 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.458 HH11 ' HB3' ' A' ' 108' ' ' PRO . 13.2 mtp180 -64.38 -20.93 66.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.105 -0.997 . . . . 0.0 111.282 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.35 3.01 58.82 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.723 -1.751 . . . . 0.0 108.723 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.483 ' O ' ' CE ' ' A' ' 36' ' ' MET . 34.3 p -117.6 83.67 17.82 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.46 -1.024 . . . . 0.0 108.874 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -91.57 139.84 2.39 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 123.054 2.503 . . . . 0.0 112.146 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 78.3 mt -73.46 99.0 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.02 -1.05 . . . . 0.0 109.026 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 94.2 m-20 -64.82 -45.48 86.02 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -133.99 132.58 40.29 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' CD1' ' A' ' 16' ' ' LEU . 2.0 mt -70.97 142.66 88.02 Favored Pre-proline 0 C--N 1.299 -1.607 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.702 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -66.69 134.02 33.76 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.221 1.281 . . . . 0.0 109.095 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.15 145.71 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.884 -1.135 . . . . 0.0 110.068 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.719 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.7 mtp -141.56 118.84 11.42 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.43 43.13 1.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm 57.35 22.48 7.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.752 -0.593 . . . . 0.0 109.649 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.1 m -136.4 152.93 51.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 109.416 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.3 m -68.03 147.69 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 109.11 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.719 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.1 tp -79.45 123.17 27.28 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.412 -0.805 . . . . 0.0 110.369 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.529 ' CG ' HH22 ' A' ' 25' ' ' ARG . 12.1 m-20 -63.05 92.38 0.05 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.52 -0.738 . . . . 0.0 109.495 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.53 -27.57 57.83 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.989 -1.069 . . . . 0.0 109.718 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -78.21 -59.97 2.56 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.067 -1.021 . . . . 0.0 111.615 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -58.59 -36.33 73.83 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.743 -1.223 . . . . 0.0 109.871 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.549 HD22 HD21 ' A' ' 54' ' ' LEU . 28.7 tp -62.93 -42.86 99.94 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.442 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.2 t80 -62.83 -68.08 0.37 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 60' ' ' TYR . 61.8 t30 -42.78 -34.67 0.97 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.469 -0.769 . . . . 0.0 109.35 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.883 HD22 HH22 ' A' ' 66' ' ' ARG . 13.6 mt -71.66 -50.89 26.33 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.844 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.6 t -56.6 -43.14 77.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.494 -0.754 . . . . 0.0 110.067 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.442 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.6 mm -69.68 -34.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.69 -1.256 . . . . 0.0 108.027 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.409 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.51 -20.11 29.21 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.146 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.883 HH22 HD22 ' A' ' 62' ' ' LEU . 15.6 mmt-85 -95.13 -1.34 52.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.644 -1.285 . . . . 0.0 108.438 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.85 16.46 72.66 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.238 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.426 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 140.98 130.31 2.59 Favored Glycine 0 N--CA 1.502 3.049 0 CA-C-N 119.569 1.685 . . . . 0.0 111.618 178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.646 HD11 ' CH2' ' A' ' 78' ' ' TRP . 13.1 tp -50.95 -41.83 59.34 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.631 -0.923 . . . . 0.0 110.465 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.0 t -57.86 -43.05 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.952 -1.092 . . . . 0.0 109.25 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -55.95 -37.5 69.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.111 -0.993 . . . . 0.0 108.656 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.1 t -66.73 -43.99 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.632 -0.667 . . . . 0.0 109.975 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.15 -57.58 9.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.759 -1.213 . . . . 0.0 110.124 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.518 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 70.7 m-20 -58.02 -42.08 84.52 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.246 -0.909 . . . . 0.0 110.354 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.61 -9.02 39.44 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.279 -0.888 . . . . 0.0 110.692 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.626 ' N ' ' O ' ' A' ' 72' ' ' VAL . 25.1 mtmt 58.46 57.62 3.76 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.462 -0.773 . . . . 0.0 110.265 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.9 mt -91.37 12.63 19.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.951 -1.093 . . . . 0.0 108.594 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.646 ' CH2' HD11 ' A' ' 69' ' ' LEU . 87.6 m95 -61.11 -40.81 95.18 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt-30 -48.44 -40.93 27.9 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.898 -1.126 . . . . 0.0 108.749 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.708 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -66.61 -38.9 87.94 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.424 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.1 mt -72.9 -52.71 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.645 HD11 ' HB2' ' A' ' 95' ' ' ALA . 63.7 mt -54.15 -56.19 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.578 -0.701 . . . . 0.0 109.491 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 86' ' ' HIS . 44.9 mttp -66.68 -41.14 88.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.095 -1.003 . . . . 0.0 109.631 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.82 -30.67 29.58 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 mt -90.47 -8.78 49.59 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.428 -1.042 . . . . 0.0 109.099 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 83' ' ' LYS . 37.1 m-70 63.78 42.41 6.19 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.591 -0.693 . . . . 0.0 109.868 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.72 139.41 80.52 Favored Pre-proline 0 C--N 1.304 -1.405 0 O-C-N 121.242 -0.911 . . . . 0.0 108.583 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 40.0 Cg_endo -69.93 142.95 48.56 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 121.915 1.743 . . . . 0.0 112.213 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.9 t -55.94 0.61 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.259 -0.901 . . . . 0.0 109.814 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 93.2 p -66.84 -26.0 66.7 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.222 -0.924 . . . . 0.0 110.193 -178.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.541 HD11 ' H ' ' A' ' 50' ' ' ALA . 87.4 mt -101.47 107.41 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 120.92 -1.112 . . . . 0.0 109.522 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.9 p -79.05 -25.32 43.17 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.251 -0.905 . . . . 0.0 109.027 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -95.33 35.02 1.35 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.561 -0.712 . . . . 0.0 109.445 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.61 -65.2 0.73 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.138 -0.976 . . . . 0.0 108.631 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.645 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.17 -52.98 18.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.302 -0.874 . . . . 0.0 109.21 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.412 ' O ' ' OG1' ' A' ' 100' ' ' THR . 9.0 tp -58.95 -43.97 91.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.992 -1.067 . . . . 0.0 109.182 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 m -61.71 -39.96 93.36 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.953 -1.092 . . . . 0.0 108.692 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.503 HD22 HD13 ' A' ' 59' ' ' LEU . 12.0 mt -67.77 -44.22 77.96 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.562 -0.711 . . . . 0.0 110.068 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.814 ' NH1' HD21 ' A' ' 129' ' ' ASN . 28.6 ttm180 -68.81 -49.96 54.18 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.287 -0.883 . . . . 0.0 111.178 -179.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -52.94 -53.18 53.27 Favored 'General case' 0 C--N 1.294 -1.837 0 C-N-CA 118.717 -1.193 . . . . 0.0 109.115 -178.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -63.83 -42.41 97.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.153 -0.967 . . . . 0.0 111.745 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.844 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.4 t80 -58.96 -43.91 91.38 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.207 -1.558 . . . . 0.0 109.395 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.75 ' HG2' HD21 ' A' ' 122' ' ' LEU . 89.7 mtp -51.52 -56.84 11.16 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.505 -0.747 . . . . 0.0 111.372 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -72.78 -52.67 14.06 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.767 -1.208 . . . . 0.0 112.701 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -85.14 -50.37 7.47 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -174.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.58 -5.02 40.13 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.126 -1.609 . . . . 0.0 114.109 -175.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.9 t80 -60.12 -38.56 60.51 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 119.687 -1.883 . . . . 0.0 109.62 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.7 Cg_exo -65.64 -54.79 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.421 2.081 . . . . 0.0 112.6 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.78 -39.55 81.4 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.367 -0.833 . . . . 0.0 109.137 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.401 ' OE1' ' N ' ' A' ' 111' ' ' CYS . 0.4 OUTLIER -73.12 -51.16 18.99 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.455 -0.778 . . . . 0.0 110.287 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -71.42 -43.02 67.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.403 -0.81 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.93 -51.09 59.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.863 -1.148 . . . . 0.0 111.033 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -74.71 -27.88 60.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.146 -0.971 . . . . 0.0 111.691 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG2' HD21 ' A' ' 116' ' ' LEU . 30.7 tptt -123.26 -30.31 3.72 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.911 -1.118 . . . . 0.0 111.298 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 111' ' ' CYS . 40.0 t30 57.41 45.95 19.01 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.819 -1.176 . . . . 0.0 110.12 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 114' ' ' LYS . 60.1 mt -67.03 -31.72 72.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.174 -0.954 . . . . 0.0 110.894 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.2 t -154.39 -166.97 2.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.94 -1.1 . . . . 0.0 111.316 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.508 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.0 p -127.79 158.46 70.27 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.646 -0.659 . . . . 0.0 109.98 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -55.87 -41.32 78.43 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 121.651 1.567 . . . . 0.0 112.256 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.31 90.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.849 -1.157 . . . . 0.0 109.668 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.07 -42.4 89.47 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 103' ' ' MET . 27.9 tp -68.49 -52.71 29.31 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.71 -0.619 . . . . 0.0 110.173 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -58.26 -46.41 86.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.382 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.48 -42.23 98.47 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -0.854 . . . . 0.0 110.162 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.518 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -67.72 -33.62 75.24 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.599 HD11 ' SD ' ' A' ' 103' ' ' MET . 11.1 mt -65.9 -46.49 88.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.409 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 61.7 t0 -64.73 -37.76 88.68 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.982 -1.074 . . . . 0.0 109.391 179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.37 -29.86 75.61 Favored Glycine 0 N--CA 1.492 2.397 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.033 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.814 HD21 ' NH1' ' A' ' 99' ' ' ARG . 33.9 p-10 -92.0 -31.43 15.6 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.863 -1.374 . . . . 0.0 111.424 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.651 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 76.3 mtm180 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 120.516 -1.365 . . . . 0.0 110.237 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.771 ' O ' HG12 ' A' ' 13' ' ' VAL . 36.0 mm-40 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 120.759 0.314 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -49.2 -46.67 45.96 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.724 -1.235 . . . . 0.0 109.252 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -61.18 -40.73 95.01 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.43 -0.794 . . . . 0.0 109.532 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.49 -53.17 25.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.323 -0.861 . . . . 0.0 111.404 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -68.87 -36.14 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 120.803 -1.186 . . . . 0.0 109.279 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -58.74 -38.44 78.39 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.301 -1.499 . . . . 0.0 108.03 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 10.0 mm-40 -59.41 -31.71 69.51 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.218 -0.926 . . . . 0.0 108.655 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.494 ' HB3' HD13 ' A' ' 29' ' ' LEU . 7.0 mt -67.09 -40.37 86.96 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.31 -0.869 . . . . 0.0 111.166 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.457 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 83.3 m-85 -74.9 -35.59 62.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.487 -1.383 . . . . 0.0 109.595 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.483 ' O ' ' C ' ' A' ' 19' ' ' ILE . 99.1 mt-10 -64.43 -29.9 70.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.627 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.508 HD13 ' NH2' ' A' ' 25' ' ' ARG . 24.2 mt -37.4 -41.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.607 -0.683 . . . . 0.0 110.702 -178.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -171.56 163.33 6.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.716 -1.24 . . . . 0.0 110.891 -178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -90.3 69.91 7.08 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.462 0.649 . . . . 0.0 109.596 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.01 94.93 27.24 Favored Pre-proline 0 N--CA 1.489 1.523 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -46.69 -44.44 21.7 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 122.166 1.911 . . . . 0.0 112.024 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -63.43 -40.37 96.97 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.179 -0.95 . . . . 0.0 108.615 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.508 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.3 ttt180 -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.433 -0.792 . . . . 0.0 109.803 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.0 -49.04 79.24 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.16 -0.963 . . . . 0.0 108.686 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -53.61 -38.25 63.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.463 -0.773 . . . . 0.0 109.385 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -64.03 -59.84 3.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.465 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 16' ' ' LEU . 28.4 mt -56.45 -45.54 80.77 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.124 -0.985 . . . . 0.0 108.657 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.457 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 40.8 m-20 -60.15 -47.95 83.79 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.567 -0.853 . . . . 0.0 108.843 179.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -66.41 -43.49 85.6 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.484 -0.76 . . . . 0.0 109.889 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 tp -58.64 -49.75 76.37 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.211 -0.931 . . . . 0.0 110.306 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.6 ' CE1' HD12 ' A' ' 43' ' ' ILE . 49.4 m-85 -59.92 -36.93 78.07 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.953 -1.499 . . . . 0.0 107.792 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.4 m -69.71 -49.86 49.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.363 -0.836 . . . . 0.0 109.813 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.411 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 72.9 t80 -59.12 -46.21 88.92 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.302 -0.874 . . . . 0.0 111.123 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.401 ' SD ' HD11 ' A' ' 43' ' ' ILE . 95.4 mtp -57.36 -34.76 69.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.75 -178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -55.6 -34.99 65.35 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.647 -1.283 . . . . 0.0 108.784 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -74.75 -34.71 62.57 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 25.3 mmm180 -66.25 -30.97 71.51 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.028 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.23 0.17 63.5 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.0 p -115.25 85.18 12.39 Favored Pre-proline 0 N--CA 1.486 1.35 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.94 140.56 14.42 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 121.94 1.76 . . . . 0.0 110.513 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.6 HD12 ' CE1' ' A' ' 33' ' ' PHE . 29.8 mt -70.47 92.03 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 120.936 -1.103 . . . . 0.0 110.591 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 21.7 m120 -58.9 -30.1 67.54 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -167.17 140.08 3.49 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.573 HD23 HG21 ' A' ' 43' ' ' ILE . 17.1 mt -70.69 144.13 90.65 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.857 -1.152 . . . . 0.0 110.237 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.41 134.22 18.6 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.516 1.477 . . . . 0.0 108.369 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.45 HG23 ' N ' ' A' ' 52' ' ' SER . 56.6 mt -103.18 142.51 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 110.842 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.568 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.2 mtp -136.24 123.95 22.44 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.04 39.97 4.2 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt 57.57 22.39 8.12 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.273 0.558 . . . . 0.0 110.119 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.45 ' N ' HG23 ' A' ' 48' ' ' ILE . 49.3 m -134.38 151.16 51.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.257 -0.902 . . . . 0.0 109.22 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.56 143.46 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 120.774 -1.204 . . . . 0.0 108.708 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 HD22 ' A' ' 59' ' ' LEU . 64.3 tp -74.58 123.02 24.04 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.258 -0.901 . . . . 0.0 109.468 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -56.41 105.28 0.19 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.72 -30.57 71.58 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -80.21 -64.96 1.07 Allowed 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.238 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -52.95 -39.82 63.2 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 120.623 -1.298 . . . . 0.0 108.755 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.546 HD22 HD21 ' A' ' 54' ' ' LEU . 24.1 tp -55.8 -48.7 74.92 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.2 t80 -62.75 -66.8 0.49 Allowed 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.442 0.639 . . . . 0.0 109.913 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -43.06 -40.51 3.16 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.459 -0.776 . . . . 0.0 110.905 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.432 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -72.66 -47.07 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 117.897 -1.521 . . . . 0.0 107.836 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.785 HG21 ' CE2' ' A' ' 102' ' ' TYR . 26.6 t -55.34 -42.65 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.954 . . . . 0.0 109.987 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.409 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.0 mm -68.41 -35.67 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 120.504 -1.372 . . . . 0.0 107.715 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.85 -17.39 23.42 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.961 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.673 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.9 mmt-85 -96.99 5.3 50.7 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.524 -1.36 . . . . 0.0 108.986 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.6 11.24 82.14 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.646 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.99 134.56 3.29 Favored Glycine 0 N--CA 1.5 2.95 0 CA-C-N 119.252 1.526 . . . . 0.0 111.413 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 tp -48.55 -42.67 34.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.708 -0.877 . . . . 0.0 110.832 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.507 HG22 ' HA ' ' A' ' 122' ' ' LEU . 95.1 t -58.11 -40.64 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.0 110.005 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -58.59 -40.36 82.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.002 . . . . 0.0 110.034 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.581 ' O ' ' N ' ' A' ' 76' ' ' LYS . 40.3 t -64.55 -47.01 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.264 -0.897 . . . . 0.0 110.639 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.08 -56.68 16.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.814 -1.179 . . . . 0.0 109.894 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.653 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 86.7 m-20 -59.56 -43.69 93.49 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.284 -0.885 . . . . 0.0 111.568 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -94.05 -4.46 49.41 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.909 -1.119 . . . . 0.0 110.685 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.581 ' N ' ' O ' ' A' ' 72' ' ' VAL . 51.0 mttm 59.24 56.74 3.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.595 -0.691 . . . . 0.0 111.135 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.6 mt -90.51 13.84 14.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.561 -1.256 . . . . 0.0 107.941 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' ILE . 96.9 m95 -63.49 -41.41 98.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.43 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.9 mt-30 -47.86 -39.92 19.98 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 120.809 -1.182 . . . . 0.0 108.011 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.673 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.3 mt-10 -67.33 -38.54 85.07 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.463 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.0 mt -74.78 -51.91 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.37 -0.831 . . . . 0.0 108.987 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.654 HD11 ' HB2' ' A' ' 95' ' ' ALA . 60.8 mt -50.58 -51.47 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -74.65 -37.4 62.76 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.592 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.44 -32.92 46.18 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 83.2 mt -91.17 -7.31 51.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.38 -1.071 . . . . 0.0 109.255 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 65.03 40.59 5.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.777 -0.577 . . . . 0.0 110.106 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.3 mt -72.5 136.83 80.82 Favored Pre-proline 0 N--CA 1.488 1.467 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 35.7 Cg_endo -68.54 144.23 60.06 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.891 1.727 . . . . 0.0 112.48 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.0 p -58.19 0.66 0.06 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.265 -0.897 . . . . 0.0 109.654 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 18.0 m -64.07 -35.31 80.32 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.138 -0.976 . . . . 0.0 109.301 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.594 HD11 ' H ' ' A' ' 50' ' ' ALA . 89.5 mt -90.07 97.41 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.939 -1.101 . . . . 0.0 108.54 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 68.7 p -66.62 -27.86 68.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.873 . . . . 0.0 109.813 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.8 m -102.46 47.77 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.169 -0.957 . . . . 0.0 109.512 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.71 -59.43 3.58 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.169 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.654 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.83 -51.14 23.91 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.287 -0.883 . . . . 0.0 109.879 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.474 HD12 HH21 ' A' ' 99' ' ' ARG . 5.6 tp -58.4 -44.29 88.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.748 -1.22 . . . . 0.0 109.039 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.3 m -60.81 -40.46 92.78 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.152 -0.968 . . . . 0.0 108.694 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.433 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 10.5 mt -71.18 -44.28 65.76 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.483 -0.761 . . . . 0.0 109.941 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.798 HH12 HD21 ' A' ' 129' ' ' ASN . 40.9 ttp180 -66.5 -53.1 38.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.24 -0.912 . . . . 0.0 110.947 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -56.59 -52.28 65.42 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.473 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -62.46 -40.08 95.46 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.046 -1.034 . . . . 0.0 110.978 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.785 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.7 t80 -57.08 -41.0 78.02 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.382 -1.449 . . . . 0.0 109.2 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.571 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -54.65 -54.72 37.89 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.463 -0.773 . . . . 0.0 111.396 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.8 mttt -72.65 -50.54 24.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.564 -1.335 . . . . 0.0 113.098 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.463 ' C ' HD12 ' A' ' 106' ' ' LEU . 34.3 m-85 -84.8 -52.86 5.74 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -174.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.0 mp -100.44 12.65 36.76 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.222 -1.549 . . . . 0.0 114.391 -175.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.525 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 62.7 t80 -67.37 -38.65 16.6 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 119.796 -1.815 . . . . 0.0 111.815 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.1 Cg_endo -78.05 -40.09 0.41 Allowed 'Trans proline' 0 N--CA 1.49 1.302 0 C-N-CA 121.475 1.45 . . . . 0.0 112.834 -178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.14 -42.97 87.04 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -68.96 -51.89 34.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.634 -0.666 . . . . 0.0 110.256 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.526 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.7 m -71.45 -43.69 66.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.376 -0.827 . . . . 0.0 110.932 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 46.4 tp10 -66.72 -50.26 63.38 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.086 -1.009 . . . . 0.0 111.223 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -75.83 -26.54 57.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.021 -1.049 . . . . 0.0 111.402 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.431 ' HG2' HD21 ' A' ' 116' ' ' LEU . 29.1 tptt -125.33 -30.46 3.14 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.043 -1.036 . . . . 0.0 111.82 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.3 OUTLIER 59.66 45.11 13.46 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.737 -1.227 . . . . 0.0 110.206 179.672 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.431 HD21 ' HG2' ' A' ' 114' ' ' LYS . 84.6 mt -69.57 -32.15 70.76 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.136 -0.978 . . . . 0.0 111.288 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 118' ' ' THR . 32.0 t -153.12 -167.04 2.6 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.515 -1.274 . . . . 0.0 112.064 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.531 ' N ' ' OG ' ' A' ' 117' ' ' SER . 40.1 p -129.81 155.26 80.75 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 121.835 -0.541 . . . . 0.0 109.695 -178.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.01 -40.63 80.4 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.112 1.875 . . . . 0.0 112.122 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.79 88.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.821 -1.174 . . . . 0.0 109.254 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.67 -45.25 79.53 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.571 HD21 ' HG3' ' A' ' 103' ' ' MET . 34.6 tp -65.97 -51.77 55.5 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -57.26 -47.34 81.67 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.234 -0.916 . . . . 0.0 109.533 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.84 90.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.402 -0.811 . . . . 0.0 109.873 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.653 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.46 -36.09 78.51 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.055 0.931 . . . . 0.0 108.547 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.427 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 34.1 mt -65.59 -48.33 83.05 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.031 0 CA-C-O 121.521 0.677 . . . . 0.0 109.191 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -64.19 -37.22 86.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.406 -0.809 . . . . 0.0 109.095 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.6 -36.01 92.62 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.798 HD21 HH12 ' A' ' 99' ' ' ARG . 0.1 OUTLIER -93.87 -36.0 12.43 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.115 -1.226 . . . . 0.0 110.63 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.662 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 57.4 mtp180 . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.677 -1.264 . . . . 0.0 109.778 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -53.55 -48.52 69.03 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.308 -0.87 . . . . 0.0 109.471 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -62.45 -38.97 91.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.101 -0.999 . . . . 0.0 109.204 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.31 -48.74 72.04 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.77 . . . . 0.0 110.386 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -74.06 -34.67 39.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 O-C-N 120.761 -1.212 . . . . 0.0 108.218 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -54.65 -40.6 69.18 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 12.1 mm-40 -59.49 -31.08 69.03 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.7 mt -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.829 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.7 m-85 -81.54 -32.24 32.36 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.536 -1.352 . . . . 0.0 110.458 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.486 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.6 mt-10 -67.73 -31.02 70.67 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.827 -1.171 . . . . 0.0 110.432 -178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 16' ' ' LEU . 14.6 mt -35.28 -39.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.784 -0.572 . . . . 0.0 110.556 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.573 ' ND2' ' OD1' ' A' ' 22' ' ' ASP . 41.3 p-10 -173.72 167.06 4.5 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.97 -1.081 . . . . 0.0 110.034 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -94.22 64.75 3.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.624 -0.673 . . . . 0.0 109.821 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.573 ' OD1' ' ND2' ' A' ' 20' ' ' ASN . 1.7 m-20 -96.33 141.4 23.06 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.061 -1.024 . . . . 0.0 108.811 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.48 -61.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.14 1.893 . . . . 0.0 112.329 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -60.81 -34.09 74.01 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.858 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.718 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -55.53 -44.95 77.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.98 -1.075 . . . . 0.0 109.954 -179.109 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -61.89 -54.71 38.28 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.04 -1.037 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.05 -37.91 61.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 108.872 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -61.37 -62.81 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.396 -0.815 . . . . 0.0 109.392 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.503 HD11 ' NH1' ' A' ' 25' ' ' ARG . 69.2 mt -54.17 -47.74 71.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.538 -0.726 . . . . 0.0 109.684 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.31 -49.26 77.72 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.197 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -66.63 -42.3 86.99 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.998 -1.064 . . . . 0.0 109.635 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.67 -52.53 65.06 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.271 -0.893 . . . . 0.0 110.356 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -60.54 -34.34 73.99 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.984 -1.486 . . . . 0.0 107.74 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.3 m -69.29 -53.43 19.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.372 -0.83 . . . . 0.0 109.51 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.409 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 72.2 t80 -59.51 -40.13 86.07 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.568 -0.707 . . . . 0.0 110.57 -179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 75.3 mmm -58.96 -37.8 77.61 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.333 -0.854 . . . . 0.0 110.83 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.93 -39.41 94.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.909 -1.119 . . . . 0.0 110.286 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -69.47 -30.58 68.5 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.91 -1.119 . . . . 0.0 108.358 179.417 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.431 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -67.27 -30.58 70.49 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.76 -2.21 58.47 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 107.389 -2.284 . . . . 0.0 107.389 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 75.2 p -118.86 84.41 25.6 Favored Pre-proline 0 N--CA 1.491 1.597 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -83.02 137.15 8.4 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.561 2.174 . . . . 0.0 111.082 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.9 mt -73.98 97.73 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.038 -1.038 . . . . 0.0 109.94 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -65.41 -43.68 89.81 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.578 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.33 133.4 38.78 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.422 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.4 mt -70.33 146.64 94.6 Favored Pre-proline 0 C--N 1.298 -1.65 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.528 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -67.08 127.29 16.54 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 121.209 1.273 . . . . 0.0 109.186 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.0 mt -96.11 143.67 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.848 -1.158 . . . . 0.0 109.763 -178.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.841 ' SD ' HG21 ' A' ' 97' ' ' THR . 57.3 mmm -140.54 123.35 16.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.669 0.747 . . . . 0.0 108.991 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.4 41.42 3.27 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.1 mttt 57.93 23.32 9.7 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.45 0.643 . . . . 0.0 109.89 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 89.7 p -136.98 155.62 49.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 108.936 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.28 148.42 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.972 -1.08 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HG3' ' A' ' 49' ' ' MET . 34.5 tp -81.66 122.91 28.22 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.685 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -65.17 89.43 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 0.0 109.07 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.5 mt -56.06 -23.54 34.13 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 120.786 -1.196 . . . . 0.0 109.168 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -78.43 -56.21 4.62 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.36 -0.838 . . . . 0.0 111.437 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.81 -39.33 91.35 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.815 -1.178 . . . . 0.0 110.132 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.7 -44.28 93.75 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.083 -1.011 . . . . 0.0 108.286 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HD1' ' HH ' ' A' ' 102' ' ' TYR . 52.9 t80 -56.21 -67.17 0.32 Allowed 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -43.17 -39.16 2.75 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 111.138 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.579 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 7.8 mt -70.66 -44.36 67.25 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 118.057 -1.457 . . . . 0.0 107.562 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.82 HG21 ' CE2' ' A' ' 102' ' ' TYR . 48.6 t -59.44 -45.05 93.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.264 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 64' ' ' ILE . 6.0 mm -68.22 -34.8 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.637 -1.289 . . . . 0.0 108.367 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.58 -26.95 35.52 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.774 -0.578 . . . . 0.0 110.358 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.9 mpt_? -90.74 -0.55 57.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.441 -1.412 . . . . 0.0 108.914 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.54 19.74 61.44 Favored Glycine 0 N--CA 1.489 2.221 0 C-N-CA 120.386 -0.912 . . . . 0.0 111.808 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.412 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 138.44 131.9 2.93 Favored Glycine 0 N--CA 1.499 2.838 0 O-C-N 120.672 -1.487 . . . . 0.0 111.418 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.553 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.1 tp -49.65 -39.54 36.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.617 -0.931 . . . . 0.0 109.914 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 122' ' ' LEU . 83.4 t -58.29 -43.22 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.212 -0.93 . . . . 0.0 109.907 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -54.99 -39.37 68.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.725 -1.234 . . . . 0.0 109.045 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.599 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.0 t -63.37 -42.11 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.49 -0.756 . . . . 0.0 109.845 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 HH11 ' A' ' 99' ' ' ARG . 72.7 mt -66.61 -58.52 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.661 -1.274 . . . . 0.0 110.454 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -56.64 -42.47 78.97 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.36 -9.46 38.73 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.22 -0.925 . . . . 0.0 110.826 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 72' ' ' VAL . 40.3 mttp 58.17 60.81 2.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.211 -0.93 . . . . 0.0 110.292 -178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 15.7 mt -93.23 16.24 13.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.017 -1.052 . . . . 0.0 108.497 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.553 ' HH2' HD11 ' A' ' 69' ' ' LEU . 82.3 m95 -64.78 -39.07 93.01 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.424 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.1 mm-40 -49.54 -38.28 30.28 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 118.425 -1.31 . . . . 0.0 108.093 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -69.26 -40.57 77.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 mt -71.75 -53.33 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.431 -0.793 . . . . 0.0 109.062 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.1 mt -51.48 -53.7 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 109.19 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -68.94 -39.15 79.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.223 -0.923 . . . . 0.0 110.201 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.7 -32.63 47.5 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.458 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 1.1 mm? -89.18 -7.95 54.61 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.385 -1.068 . . . . 0.0 108.7 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 63.96 42.34 5.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.837 -0.54 . . . . 0.0 110.331 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 142.16 83.62 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.201 -0.937 . . . . 0.0 108.934 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.582 ' C ' ' H ' ' A' ' 90' ' ' SER . 36.5 Cg_endo -69.86 143.2 49.59 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 C-N-CA 122.063 1.842 . . . . 0.0 112.456 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.7 p -55.61 -1.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.414 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.582 ' H ' ' C ' ' A' ' 88' ' ' PRO . 23.3 m -64.43 -34.19 77.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 110.154 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.552 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.0 mt -90.99 97.5 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 120.738 -1.226 . . . . 0.0 109.243 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 69.1 p -70.45 -21.92 62.75 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.284 -0.885 . . . . 0.0 109.194 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 57.9 m -104.25 43.37 1.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.467 -0.771 . . . . 0.0 109.159 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.39 -61.19 2.26 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.331 -0.856 . . . . 0.0 109.319 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.4 -50.47 30.8 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 109.807 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 7.7 tp -58.02 -46.06 85.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.765 -1.209 . . . . 0.0 109.116 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.841 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.2 m -58.92 -41.08 86.44 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.047 -1.033 . . . . 0.0 108.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.19 -44.46 68.66 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.802 . . . . 0.0 109.507 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.469 ' HG3' HH11 ' A' ' 99' ' ' ARG . 6.7 ttm-85 -65.81 -55.04 19.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.981 -1.074 . . . . 0.0 111.017 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.4 m -57.22 -52.9 63.46 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.436 -0.79 . . . . 0.0 111.003 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.66 -43.79 97.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.071 -1.018 . . . . 0.0 111.715 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.82 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.1 t80 -57.69 -39.65 77.66 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.356 -1.465 . . . . 0.0 109.595 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -54.46 -54.72 37.12 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.28 -0.888 . . . . 0.0 111.65 -178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -72.87 -52.88 13.03 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.477 -1.389 . . . . 0.0 113.198 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -84.68 -50.33 7.73 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.571 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.2 mp -97.2 6.23 48.78 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.235 -1.541 . . . . 0.0 113.863 -176.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.596 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 68.8 t80 -67.74 -37.01 10.85 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 119.955 -1.716 . . . . 0.0 111.684 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 60.6 Cg_endo -78.75 -40.98 0.26 Allowed 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 121.354 1.369 . . . . 0.0 112.096 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.54 -42.97 89.07 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -70.86 -46.04 63.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.599 -0.688 . . . . 0.0 110.072 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.1 t -77.03 -45.81 25.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.337 -0.852 . . . . 0.0 110.611 -178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.5 tp10 -66.22 -47.13 74.82 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.099 -1.001 . . . . 0.0 110.856 -178.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -76.61 -33.63 58.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.095 -1.003 . . . . 0.0 111.417 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.492 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.6 tptp -119.6 -27.43 5.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 111.783 -177.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 111' ' ' CYS . 24.1 t-20 55.76 45.34 24.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.78 -1.2 . . . . 0.0 110.389 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 114' ' ' LYS . 73.1 mt -67.24 -31.34 71.63 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.176 -0.952 . . . . 0.0 110.966 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.5 t -154.65 -167.0 2.47 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 118.746 -1.182 . . . . 0.0 111.576 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.522 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.6 p -122.06 152.67 60.34 Favored Pre-proline 0 N--CA 1.497 1.907 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.596 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 10.9 Cg_endo -55.85 -38.76 94.09 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.883 1.722 . . . . 0.0 112.092 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.95 -37.71 88.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.98 -1.075 . . . . 0.0 109.539 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.431 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.7 mt-10 -66.96 -43.42 83.15 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 103' ' ' MET . 15.6 tp -64.31 -52.92 56.11 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.536 -0.728 . . . . 0.0 109.657 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -58.62 -47.25 84.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.331 -0.855 . . . . 0.0 109.794 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.12 -38.68 87.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 110.033 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.84 -34.04 76.92 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.543 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -68.42 -45.61 81.93 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 N-CA-C 108.102 -1.074 . . . . 0.0 108.102 177.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.477 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 62.5 t0 -58.94 -40.05 83.47 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.046 -1.034 . . . . 0.0 108.799 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.14 -26.83 73.73 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 17.5 p-10 -89.49 -31.82 17.49 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.766 -1.432 . . . . 0.0 110.595 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.652 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 85.5 mtm180 . . . . . 0 N--CA 1.492 1.636 0 O-C-N 120.662 -1.273 . . . . 0.0 110.083 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.608 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 36.2 mt-30 . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 120.631 0.253 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -54.24 -49.54 69.24 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.694 -1.254 . . . . 0.0 110.052 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -62.02 -42.32 99.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.068 -1.02 . . . . 0.0 109.453 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.04 -47.27 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.261 -0.899 . . . . 0.0 110.891 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.582 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -72.67 -36.7 53.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 120.58 -1.325 . . . . 0.0 108.8 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -53.49 -40.44 65.36 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -59.45 -31.3 69.18 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.466 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -72.91 -36.33 67.24 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.462 -0.773 . . . . 0.0 111.633 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.481 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -79.05 -33.38 44.76 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.318 -1.489 . . . . 0.0 110.769 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.5 mm-40 -67.18 -26.35 66.6 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.888 -1.132 . . . . 0.0 110.528 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.474 ' C ' ' O ' ' A' ' 18' ' ' GLU . 28.7 mt -37.79 -39.55 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.617 -0.677 . . . . 0.0 110.694 -178.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -171.65 163.76 6.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.752 -1.218 . . . . 0.0 110.321 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -90.0 65.18 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.696 -0.627 . . . . 0.0 110.213 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -112.44 95.87 33.52 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.464 -0.773 . . . . 0.0 108.976 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.61 -40.16 30.2 Favored 'Trans proline' 0 N--CA 1.493 1.441 0 C-N-CA 122.358 2.038 . . . . 0.0 112.272 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -60.91 -41.1 95.46 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.02 -1.05 . . . . 0.0 108.592 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.706 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -59.79 -39.02 83.55 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.485 -0.76 . . . . 0.0 109.416 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.593 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 57.7 tttm -59.94 -50.58 73.2 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.16 -39.17 63.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -63.42 -61.86 2.06 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.486 -0.759 . . . . 0.0 109.539 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.566 HD21 HH12 ' A' ' 25' ' ' ARG . 74.7 mt -56.14 -46.73 79.13 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.345 -0.847 . . . . 0.0 109.067 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.593 ' OD2' ' NZ ' ' A' ' 26' ' ' LYS . 70.3 m-20 -62.29 -52.14 64.91 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.702 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.81 -40.87 92.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.244 -0.91 . . . . 0.0 109.188 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -57.23 -55.69 31.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.334 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.9 m-85 -60.63 -34.05 73.69 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.08 -1.448 . . . . 0.0 107.979 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -69.96 -52.95 20.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.514 -0.741 . . . . 0.0 110.614 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -60.19 -43.57 95.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 111.908 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 98.1 mtp -57.86 -34.36 69.67 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.095 -1.003 . . . . 0.0 111.123 -178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -54.12 -40.18 67.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.622 -1.299 . . . . 0.0 108.169 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -67.21 -37.53 83.78 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.469 -0.769 . . . . 0.0 109.358 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.418 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.6 mmm180 -63.5 -31.66 72.88 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.729 -0.607 . . . . 0.0 109.602 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.41 -2.96 61.2 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 108.238 -1.945 . . . . 0.0 108.238 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 39.6 p -118.99 85.18 28.41 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -83.49 144.6 11.48 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.58 2.187 . . . . 0.0 111.666 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.608 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 8.9 mt -77.13 94.07 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.109 -0.995 . . . . 0.0 109.264 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -61.0 -35.33 76.57 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.617 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -148.44 136.04 20.61 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.466 HD13 ' CD1' ' A' ' 16' ' ' LEU . 1.7 mt -71.45 145.49 90.43 Favored Pre-proline 0 C--N 1.297 -1.692 0 O-C-N 120.987 -1.071 . . . . 0.0 109.003 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -67.39 133.69 31.05 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 N-CA-C 108.982 -1.199 . . . . 0.0 108.982 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.7 mt -101.59 145.51 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.887 -1.133 . . . . 0.0 109.945 -178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.739 ' SD ' HD13 ' A' ' 54' ' ' LEU . 81.3 mtp -144.67 118.74 9.42 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 73.15 37.98 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mttt 57.79 25.15 11.59 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.639 0.733 . . . . 0.0 109.29 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 93.3 p -136.85 154.87 50.39 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.3 m -68.04 145.32 13.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.176 -0.953 . . . . 0.0 109.076 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.739 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.8 tp -77.92 123.61 27.0 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.306 -0.872 . . . . 0.0 109.512 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -62.89 88.51 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.8 mt -53.96 -25.43 20.65 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.87 -1.144 . . . . 0.0 108.957 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -78.86 -52.69 7.97 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.342 -0.849 . . . . 0.0 111.984 -178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -64.38 -37.34 87.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.556 -1.34 . . . . 0.0 110.165 -178.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 98' ' ' LEU . 56.4 tp -58.79 -44.03 90.62 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.969 ' CE1' HD11 ' A' ' 64' ' ' ILE . 56.6 t80 -56.36 -73.66 0.06 Allowed 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -39.36 -41.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.257 -0.902 . . . . 0.0 111.782 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mt -71.46 -44.48 64.71 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 117.943 -1.503 . . . . 0.0 107.945 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.682 HG21 ' CE2' ' A' ' 102' ' ' TYR . 19.1 t -59.34 -46.69 92.3 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.164 179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.969 HD11 ' CE1' ' A' ' 60' ' ' TYR . 5.5 mm -68.99 -35.59 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.769 -1.207 . . . . 0.0 107.843 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.415 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.57 -23.0 9.5 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.628 -178.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.521 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.4 mpt_? -92.26 -1.94 56.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.648 -1.283 . . . . 0.0 108.782 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.48 19.47 64.07 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.166 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.07 127.54 2.23 Favored Glycine 0 N--CA 1.5 2.929 0 CA-C-N 119.596 1.698 . . . . 0.0 111.846 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.567 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.7 tp -46.91 -39.39 12.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.586 -0.95 . . . . 0.0 109.526 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.6 t -59.43 -42.1 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.223 -0.923 . . . . 0.0 109.656 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -55.01 -42.7 72.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.036 -1.04 . . . . 0.0 109.47 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 76' ' ' LYS . 22.5 t -63.28 -43.42 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.468 -0.77 . . . . 0.0 110.201 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -64.95 -56.72 14.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 O-C-N 120.813 -1.179 . . . . 0.0 110.45 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -57.38 -41.94 81.18 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -93.6 -9.91 36.45 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.029 -1.044 . . . . 0.0 110.436 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 72' ' ' VAL . 38.6 mtmt 58.73 59.96 2.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.441 -0.787 . . . . 0.0 109.772 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.3 mt -93.01 14.38 17.89 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.189 -0.945 . . . . 0.0 108.663 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.8 m95 -62.27 -39.38 92.73 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 78' ' ' TRP . 87.6 mm-40 -49.08 -39.29 27.38 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.722 -1.236 . . . . 0.0 108.386 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HB3' HH21 ' A' ' 66' ' ' ARG . 77.1 mm-40 -69.83 -39.54 76.4 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt -71.08 -54.87 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.295 -0.878 . . . . 0.0 108.881 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.622 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.1 mt -51.24 -55.61 7.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -68.41 -36.8 79.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.063 -1.023 . . . . 0.0 109.206 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.45 -34.99 49.95 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.6 mt -88.27 -7.25 57.06 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.351 -1.088 . . . . 0.0 108.667 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 66.54 40.58 3.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.236 0.541 . . . . 0.0 110.004 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.43 142.87 81.92 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.939 . . . . 0.0 108.545 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.563 ' C ' ' H ' ' A' ' 90' ' ' SER . 42.3 Cg_endo -70.34 144.28 50.46 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.142 1.895 . . . . 0.0 112.301 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 p -57.57 -0.35 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.205 -0.935 . . . . 0.0 109.486 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 88' ' ' PRO . 13.8 m -65.01 -30.74 71.74 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.354 -0.841 . . . . 0.0 109.844 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.429 HD11 ' N ' ' A' ' 50' ' ' ALA . 70.8 mt -93.81 97.54 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 120.656 -1.278 . . . . 0.0 109.274 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.6 p -71.87 -25.0 61.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.938 . . . . 0.0 109.345 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 m -101.88 41.77 1.19 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.64 -59.58 3.02 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.349 -0.845 . . . . 0.0 109.252 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.622 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.22 -52.6 15.44 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.152 -0.967 . . . . 0.0 109.038 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.46 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.0 tp -58.63 -44.63 90.07 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.06 -1.025 . . . . 0.0 109.214 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.3 m -60.2 -40.27 89.47 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.116 -0.99 . . . . 0.0 108.903 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 59' ' ' LEU . 9.6 mt -68.77 -46.08 69.69 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.614 -0.679 . . . . 0.0 109.786 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.52 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 37.4 ttm180 -64.94 -51.42 61.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.333 -0.854 . . . . 0.0 110.884 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -54.69 -54.75 37.69 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.671 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -62.59 -42.0 99.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 0.0 111.559 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.682 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.2 t80 -58.02 -43.33 86.64 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 120.207 -1.558 . . . . 0.0 109.256 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.705 ' HG2' HD21 ' A' ' 122' ' ' LEU . 85.3 mtp -53.36 -57.43 10.62 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.734 -0.604 . . . . 0.0 112.325 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -72.82 -51.26 19.6 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.671 -1.268 . . . . 0.0 112.79 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.4 ' C ' HD12 ' A' ' 106' ' ' LEU . 71.2 m-85 -84.27 -47.41 10.8 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.545 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.5 mp -98.86 -1.43 40.18 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.33 -1.481 . . . . 0.0 114.035 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.643 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 81.1 t80 -63.12 -36.86 27.19 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 119.746 -1.846 . . . . 0.0 110.337 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.643 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.2 Cg_exo -67.07 -56.39 0.24 Allowed 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.145 1.896 . . . . 0.0 111.855 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.76 -43.44 85.45 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -72.95 -49.9 26.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.301 -0.874 . . . . 0.0 110.641 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.4 t -76.8 -43.05 38.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.156 -0.965 . . . . 0.0 111.199 -178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.5 tp10 -68.8 -50.35 50.93 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.577 -1.327 . . . . 0.0 110.996 -178.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -74.0 -35.76 64.44 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.115 -0.991 . . . . 0.0 111.699 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.2 tptp -111.02 -29.04 8.06 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.838 -1.163 . . . . 0.0 111.612 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 54.61 44.67 28.3 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.643 -1.286 . . . . 0.0 110.607 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.662 HD11 HG23 ' A' ' 64' ' ' ILE . 73.5 mt -66.07 -30.88 71.48 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.117 -0.989 . . . . 0.0 110.398 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -154.24 -166.7 2.43 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.406 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 74.2 p -127.53 159.81 63.82 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.595 -0.691 . . . . 0.0 109.753 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.45 -39.28 90.24 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.613 1.542 . . . . 0.0 112.256 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.59 -37.95 89.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.969 -1.082 . . . . 0.0 109.775 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -66.4 -44.73 82.2 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD21 ' HG2' ' A' ' 103' ' ' MET . 26.6 tp -66.66 -51.72 53.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.349 0.595 . . . . 0.0 110.08 179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -57.74 -47.02 83.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.0 109.863 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.13 91.91 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.238 -0.914 . . . . 0.0 109.877 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.96 -34.33 75.15 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.939 0.876 . . . . 0.0 108.7 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.7 HD11 ' SD ' ' A' ' 103' ' ' MET . 13.2 mt -63.59 -52.24 60.12 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -61.74 -36.85 82.17 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.458 -0.897 . . . . 0.0 109.04 179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.84 -31.64 81.08 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.666 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.92 -35.62 14.62 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.055 -1.262 . . . . 0.0 111.183 -178.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.666 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.7 mtm180 . . . . . 0 N--CA 1.492 1.667 0 O-C-N 120.714 -1.241 . . . . 0.0 110.203 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.752 ' O ' HG13 ' A' ' 13' ' ' VAL . 1.8 mp0 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.17 -50.82 70.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.405 -0.809 . . . . 0.0 109.322 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.66 -41.66 99.18 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.055 -1.028 . . . . 0.0 109.213 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.58 -48.16 75.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.337 -0.852 . . . . 0.0 110.586 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.0 m -69.68 -37.15 73.34 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 120.674 -1.266 . . . . 0.0 107.796 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -54.52 -41.52 69.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -58.95 -29.91 67.49 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.304 -0.958 . . . . 0.0 108.762 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 46' ' ' LEU . 8.9 mt -72.42 -38.45 68.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 111.333 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.44 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.0 m-85 -76.67 -33.53 58.27 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.509 -1.369 . . . . 0.0 110.457 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.3 mt-10 -65.72 -26.92 67.97 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.844 -1.16 . . . . 0.0 110.325 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.598 HG21 HH12 ' A' ' 25' ' ' ARG . 32.9 mt -38.39 -40.28 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 O-C-N 121.604 -0.685 . . . . 0.0 110.665 -179.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -170.74 164.45 8.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.744 -1.223 . . . . 0.0 110.758 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -89.84 68.38 7.41 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.396 0.617 . . . . 0.0 109.774 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -112.44 94.28 26.57 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.13 -41.72 40.61 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.01 1.807 . . . . 0.0 111.974 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -63.38 -41.72 98.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.107 -0.996 . . . . 0.0 108.611 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.598 HH12 HG21 ' A' ' 19' ' ' ILE . 66.3 ttt180 -58.68 -37.78 76.79 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.432 -0.793 . . . . 0.0 109.297 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.74 -49.35 78.06 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.359 -0.838 . . . . 0.0 108.845 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.62 -37.75 65.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.554 -0.716 . . . . 0.0 109.365 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.48 -61.22 2.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.269 -0.894 . . . . 0.0 110.695 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.45 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 54.7 mt -54.7 -47.56 73.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.284 -0.885 . . . . 0.0 109.295 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.44 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 88.1 m-20 -62.13 -46.17 90.19 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.821 -0.752 . . . . 0.0 109.395 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -67.1 -44.42 80.04 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.189 -0.944 . . . . 0.0 109.389 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.8 tp -55.56 -51.26 67.68 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.429 -0.795 . . . . 0.0 109.924 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.9 m-85 -61.0 -34.83 75.42 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 118.442 -1.303 . . . . 0.0 107.85 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -70.78 -52.84 18.08 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.559 -0.713 . . . . 0.0 110.524 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.68 -45.04 90.29 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.271 -0.893 . . . . 0.0 111.124 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.6 mtp -58.38 -33.57 69.75 Favored 'General case' 0 C--N 1.296 -1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.22 -179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -52.78 -39.12 61.99 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.96 -1.087 . . . . 0.0 108.652 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 38' ' ' LYS . 39.3 mmtt -71.03 -37.35 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -65.21 -30.45 71.35 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.76 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.73 0.74 64.11 Favored Glycine 0 N--CA 1.485 1.965 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.5 p -117.21 84.81 17.86 Favored Pre-proline 0 N--CA 1.491 1.58 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -83.77 141.14 9.53 Favored 'Trans proline' 0 C--N 1.301 -1.945 0 C-N-CA 122.507 2.138 . . . . 0.0 111.4 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.4 mt -76.36 97.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.997 -1.064 . . . . 0.0 109.725 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.487 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 24.5 t-20 -68.15 -45.94 72.18 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -130.03 132.16 46.12 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 16' ' ' LEU . 17.7 mt -70.17 128.3 91.61 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 120.889 -1.132 . . . . 0.0 109.879 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -53.32 126.35 21.37 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 N-CA-C 108.777 -1.278 . . . . 0.0 108.777 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.2 mt -99.34 142.28 15.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.946 -1.096 . . . . 0.0 110.187 -178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.647 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.6 mtp -137.99 124.43 20.7 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.77 40.42 3.21 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 57.27 22.84 8.11 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.332 0.587 . . . . 0.0 110.286 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.1 p -136.08 153.42 51.33 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.187 -0.946 . . . . 0.0 109.079 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -66.74 145.62 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.984 -1.072 . . . . 0.0 108.941 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.647 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.6 tp -80.14 124.44 28.78 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.271 -0.893 . . . . 0.0 110.023 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.592 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.0 m-20 -63.73 88.59 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -52.42 -24.86 8.55 Favored 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.883 -1.136 . . . . 0.0 109.235 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -80.3 -57.86 3.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.237 -0.914 . . . . 0.0 111.938 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -56.81 -38.24 72.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.525 -1.359 . . . . 0.0 109.34 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.51 HD22 HD21 ' A' ' 54' ' ' LEU . 60.0 tp -58.75 -52.4 65.86 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.419 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -51.91 -66.36 0.4 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.374 0.607 . . . . 0.0 109.832 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -42.83 -43.11 3.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.508 -0.745 . . . . 0.0 111.636 -178.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.49 -40.75 70.02 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.136 -1.426 . . . . 0.0 107.402 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.787 HG21 ' CE2' ' A' ' 102' ' ' TYR . 44.1 t -60.99 -45.5 98.41 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 C-N-CA 119.611 -0.836 . . . . 0.0 109.516 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.419 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.9 mm -68.75 -45.97 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.747 -1.22 . . . . 0.0 107.886 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -4.66 2.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.807 -0.558 . . . . 0.0 109.683 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.682 ' HG3' HD13 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -101.89 9.39 40.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.103 -0.998 . . . . 0.0 108.841 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.51 7.85 87.72 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.348 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 122.8 142.63 6.21 Favored Glycine 0 N--CA 1.501 2.989 0 O-C-N 121.015 -1.285 . . . . 0.0 110.999 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' OE2' ' A' ' 110' ' ' GLU . 14.8 tp -52.18 -41.41 62.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.714 -0.874 . . . . 0.0 110.77 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.481 HG11 ' HB3' ' A' ' 121' ' ' GLU . 76.2 t -57.25 -41.76 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.747 -1.221 . . . . 0.0 108.916 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -59.07 -38.79 80.28 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.936 -1.102 . . . . 0.0 109.381 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.2 t -61.8 -46.86 95.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.329 -0.857 . . . . 0.0 110.208 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.9 mt -63.9 -61.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.072 -1.018 . . . . 0.0 109.979 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -58.89 -41.33 86.9 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.577 -0.702 . . . . 0.0 110.831 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -93.2 -7.36 45.45 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.978 -1.076 . . . . 0.0 110.985 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 72' ' ' VAL . 22.6 mtmt 57.4 56.99 4.66 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.125 -0.985 . . . . 0.0 110.492 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.682 HD13 ' HG3' ' A' ' 66' ' ' ARG . 18.2 mt -89.53 13.11 14.71 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.4 m95 -62.42 -42.86 99.76 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.635 -0.666 . . . . 0.0 109.362 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.3 mm-40 -49.69 -38.32 32.53 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.806 -1.184 . . . . 0.0 108.33 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.581 ' OE1' ' NE ' ' A' ' 66' ' ' ARG . 98.6 mt-10 -68.92 -40.48 79.03 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -72.47 -54.28 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.473 -0.767 . . . . 0.0 109.172 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.51 HD11 ' HB2' ' A' ' 95' ' ' ALA . 73.1 mt -53.15 -52.87 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 121.26 -0.9 . . . . 0.0 109.219 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -69.27 -40.28 77.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 109.344 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.73 -33.73 42.81 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.8 mt -87.66 -8.32 56.31 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.376 -1.073 . . . . 0.0 108.851 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 65.26 39.89 5.15 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.4 mt -73.03 139.71 79.91 Favored Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.338 -0.851 . . . . 0.0 108.752 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.6 Cg_endo -67.26 142.57 61.06 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.946 1.764 . . . . 0.0 111.892 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -61.37 1.16 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.268 -0.895 . . . . 0.0 109.826 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 88' ' ' PRO . 60.4 p -65.65 -24.31 67.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.263 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.483 HD11 ' H ' ' A' ' 50' ' ' ALA . 90.9 mt -98.13 106.31 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.957 -1.089 . . . . 0.0 109.001 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -78.5 -22.57 47.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.107 -0.995 . . . . 0.0 108.657 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 27.8 m -95.49 34.29 1.48 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.01 -65.9 0.62 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.067 -1.021 . . . . 0.0 108.854 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.51 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.66 -52.85 27.97 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.304 -0.873 . . . . 0.0 109.52 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.488 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.4 tp -58.53 -44.29 89.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.861 -1.149 . . . . 0.0 109.044 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 m -61.79 -40.96 97.03 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 120.942 -1.099 . . . . 0.0 109.441 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.501 HD22 HD13 ' A' ' 59' ' ' LEU . 9.4 mt -68.38 -45.83 71.66 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.399 -0.813 . . . . 0.0 110.298 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.623 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 34.9 ttp180 -64.45 -49.85 69.85 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.136 -0.978 . . . . 0.0 110.622 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -56.16 -54.82 40.59 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.112 -0.992 . . . . 0.0 109.804 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -62.58 -42.59 99.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.063 -1.023 . . . . 0.0 111.024 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.787 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -56.97 -43.17 81.36 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 120.441 -1.412 . . . . 0.0 109.44 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.66 ' CE ' HD11 ' A' ' 126' ' ' ILE . 42.5 mtt -54.32 -53.9 47.59 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.491 -0.755 . . . . 0.0 111.185 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.1 mttm -72.25 -57.14 4.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.895 -1.128 . . . . 0.0 112.47 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -83.02 -15.09 52.49 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -175.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 mt -137.17 17.87 2.98 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 120.082 -1.636 . . . . 0.0 112.893 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.631 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 37.6 t80 -72.08 -35.01 3.17 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 120.153 -1.592 . . . . 0.0 110.617 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.9 Cg_endo -83.79 -39.06 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.757 1.638 . . . . 0.0 112.799 -179.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.61 -41.55 86.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.625 -1.297 . . . . 0.0 107.857 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.469 ' OE2' ' N ' ' A' ' 69' ' ' LEU . 79.0 tt0 -71.86 -50.79 26.39 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.538 -0.726 . . . . 0.0 110.067 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.578 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -74.92 -44.0 51.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.496 -0.753 . . . . 0.0 111.083 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 38.8 tp10 -66.08 -47.36 74.53 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.901 -1.124 . . . . 0.0 110.605 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -74.87 -33.94 62.16 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.162 -0.961 . . . . 0.0 111.163 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG2' HD21 ' A' ' 116' ' ' LEU . 32.8 tptt -120.52 -27.98 5.04 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.186 -0.946 . . . . 0.0 111.848 -177.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.578 ' N ' ' O ' ' A' ' 111' ' ' CYS . 35.5 t-20 57.25 44.91 21.25 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.564 -1.335 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.458 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.5 mt -67.52 -30.39 70.03 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.201 -0.937 . . . . 0.0 111.249 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.577 ' OG ' ' N ' ' A' ' 118' ' ' THR . 8.8 t -153.13 -169.1 3.22 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 118.553 -1.259 . . . . 0.0 111.743 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.577 ' N ' ' OG ' ' A' ' 117' ' ' SER . 70.1 p -126.47 163.23 41.85 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.754 -0.592 . . . . 0.0 109.643 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.6 -37.95 85.08 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 121.571 1.514 . . . . 0.0 111.971 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.54 -36.72 83.51 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.995 . . . . 0.0 109.037 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.481 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.5 mt-10 -66.87 -48.78 67.71 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.603 HD11 ' CE ' ' A' ' 103' ' ' MET . 56.5 tp -57.54 -58.01 10.18 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.525 -0.735 . . . . 0.0 109.974 178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.507 ' NE2' HD12 ' A' ' 126' ' ' ILE . 60.4 mm-40 -56.8 -45.71 82.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.496 -0.753 . . . . 0.0 109.394 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.13 -36.5 77.65 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.802 -1.186 . . . . 0.0 108.466 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.18 -35.91 74.29 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.66 HD11 ' CE ' ' A' ' 103' ' ' MET . 19.3 mt -60.14 -52.5 60.58 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -64.31 -38.03 89.58 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.01 -30.25 69.71 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.85 -32.88 13.05 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.846 -1.385 . . . . 0.0 110.94 -178.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 O-C-N 120.773 -1.204 . . . . 0.0 109.362 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 13' ' ' VAL . 42.2 mm-40 . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.65 ' CZ ' ' NE ' ' A' ' 14' ' ' ARG . 52.4 t80 -54.91 -50.18 69.44 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.29 -0.881 . . . . 0.0 108.95 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -62.86 -40.78 98.55 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.025 -1.047 . . . . 0.0 109.59 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.65 -47.98 73.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.832 . . . . 0.0 111.006 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.697 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -70.11 -38.06 73.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 120.702 -1.249 . . . . 0.0 108.992 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.65 ' NE ' ' CZ ' ' A' ' 10' ' ' PHE . 7.7 mmt-85 -55.91 -39.82 72.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.392 -1.443 . . . . 0.0 108.347 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -58.71 -29.0 66.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.453 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -75.32 -39.51 59.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.404 -0.81 . . . . 0.0 111.634 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.4 m-85 -74.86 -34.16 62.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.5 -1.375 . . . . 0.0 110.578 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 19' ' ' ILE . 77.8 mm-40 -64.77 -26.99 68.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.923 -1.111 . . . . 0.0 110.154 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.49 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 41.8 mt -39.87 -40.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.72 -0.612 . . . . 0.0 110.652 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.49 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.4 m120 -171.13 160.95 6.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.716 -1.24 . . . . 0.0 110.448 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 52.3 p30 -91.65 64.42 4.9 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.49 0.662 . . . . 0.0 109.724 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.0 107.66 60.83 Favored Pre-proline 0 N--CA 1.489 1.502 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -46.87 -51.78 8.68 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.031 1.821 . . . . 0.0 112.513 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.16 -36.1 78.89 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.169 -0.957 . . . . 0.0 109.337 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.688 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -59.41 -44.97 92.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -62.32 -53.27 57.51 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.308 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -51.69 -37.67 51.75 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.525 -0.735 . . . . 0.0 109.208 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -62.01 -62.58 1.69 Allowed 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.468 -0.77 . . . . 0.0 110.318 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.495 HD11 ' NH1' ' A' ' 25' ' ' ARG . 57.5 mt -54.77 -45.45 74.24 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.487 -0.758 . . . . 0.0 109.148 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -61.73 -47.64 84.3 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.035 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -66.68 -44.82 80.75 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.415 -0.803 . . . . 0.0 109.762 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.43 -51.74 67.25 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.349 -0.844 . . . . 0.0 110.898 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.415 ' CE1' HD12 ' A' ' 43' ' ' ILE . 42.0 m-85 -62.53 -33.06 74.15 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 118.104 -1.438 . . . . 0.0 108.207 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 m -68.99 -55.03 12.13 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.408 -0.807 . . . . 0.0 110.203 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.438 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 46.3 t80 -61.91 -38.45 88.43 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.894 . . . . 0.0 111.656 -178.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.5 mmm -58.22 -34.79 70.8 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.857 -1.152 . . . . 0.0 110.748 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -56.27 -37.63 70.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.772 -1.205 . . . . 0.0 109.25 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.1 -28.47 57.53 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 13.6 mmm180 -66.7 -32.05 73.1 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.733 -0.787 . . . . 0.0 109.428 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.55 -2.21 62.49 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.725 -2.15 . . . . 0.0 107.725 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.8 p -118.72 84.9 26.18 Favored Pre-proline 0 N--CA 1.49 1.545 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.17 12.34 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.527 2.151 . . . . 0.0 111.207 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.504 HG21 HD23 ' A' ' 46' ' ' LEU . 59.1 mt -80.82 99.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.048 -1.032 . . . . 0.0 110.042 -178.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.54 ' C ' ' NE2' ' A' ' 9' ' ' GLN . 27.5 m120 -79.11 -3.96 47.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.25 -0.906 . . . . 0.0 108.648 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -176.45 123.2 0.16 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.279 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.504 HD23 HG21 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -70.29 144.06 91.66 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 120.953 -1.092 . . . . 0.0 108.93 -179.368 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -67.08 138.85 48.89 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 121.501 1.467 . . . . 0.0 109.558 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.547 HG23 ' N ' ' A' ' 52' ' ' SER . 35.3 mt -105.55 142.69 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.02 -1.05 . . . . 0.0 110.269 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.58 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.3 mtp -134.52 125.71 27.89 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.49 40.03 8.59 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.5 mttt 58.94 25.02 13.22 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.857 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.547 ' N ' HG23 ' A' ' 48' ' ' ILE . 84.8 p -137.56 154.58 49.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.369 -0.832 . . . . 0.0 109.524 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.26 144.3 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.197 -0.939 . . . . 0.0 109.975 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.695 HD21 HD22 ' A' ' 59' ' ' LEU . 51.0 tp -77.16 122.63 25.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.544 -0.722 . . . . 0.0 109.396 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -61.86 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.656 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.28 -26.87 42.86 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 120.92 -1.112 . . . . 0.0 109.149 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -78.1 -63.46 1.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.136 -0.978 . . . . 0.0 111.564 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -57.1 -38.73 73.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.684 -1.26 . . . . 0.0 110.267 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.695 HD22 HD21 ' A' ' 54' ' ' LEU . 39.9 tp -58.72 -43.47 90.14 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.546 -1.346 . . . . 0.0 107.853 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.586 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 55.2 t80 -60.03 -67.5 0.38 Allowed 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.412 0.625 . . . . 0.0 109.547 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -41.94 -41.4 2.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.515 -0.74 . . . . 0.0 111.429 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.1 -44.07 69.74 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.12 -1.432 . . . . 0.0 107.743 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.827 HG21 ' CE2' ' A' ' 102' ' ' TYR . 23.5 t -58.14 -45.22 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.393 -0.817 . . . . 0.0 110.403 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.586 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.1 mm -71.01 -33.43 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 120.735 -1.228 . . . . 0.0 108.313 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.47 -24.38 20.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.646 -178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.496 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.9 mpt_? -92.46 -2.55 56.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.809 -1.182 . . . . 0.0 108.799 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.1 16.74 66.55 Favored Glycine 0 N--CA 1.491 2.312 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.434 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 145.28 128.11 2.0 Allowed Glycine 0 N--CA 1.498 2.801 0 CA-C-N 119.675 1.737 . . . . 0.0 111.85 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.616 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.9 tp -46.92 -38.33 10.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.63 -0.924 . . . . 0.0 109.695 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 88.0 t -60.61 -41.19 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.455 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -58.61 -42.99 89.46 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.878 -1.139 . . . . 0.0 109.695 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 76' ' ' LYS . 61.9 t -59.68 -43.43 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 109.349 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -66.84 -56.89 12.13 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 120.851 -1.156 . . . . 0.0 109.623 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.463 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.7 m-20 -57.79 -41.77 82.8 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.161 -0.962 . . . . 0.0 110.312 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -92.27 -9.58 41.55 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.178 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.616 ' N ' ' O ' ' A' ' 72' ' ' VAL . 28.3 mtmt 58.03 57.7 3.94 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -0.868 . . . . 0.0 109.67 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 12.6 mt -92.98 16.6 12.33 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.949 -1.094 . . . . 0.0 108.52 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.1 m95 -64.26 -39.75 94.59 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.439 ' C ' ' O ' ' A' ' 78' ' ' TRP . 16.3 mm100 -48.81 -38.88 23.38 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.287 -1.365 . . . . 0.0 108.026 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.496 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.8 mm-40 -69.64 -40.92 76.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.83 -54.47 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.776 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.5 mt -50.33 -54.2 9.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -68.4 -38.49 81.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.77 -34.0 50.16 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.1 mt -88.13 -8.33 55.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.35 -1.088 . . . . 0.0 108.823 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 66.25 39.5 4.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.781 -0.575 . . . . 0.0 109.934 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.0 mt -73.79 146.74 85.86 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.547 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.7 Cg_endo -74.04 139.96 27.69 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 C-N-CA 122.081 1.854 . . . . 0.0 112.149 179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.1 p -56.38 -0.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.822 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.547 ' H ' ' C ' ' A' ' 88' ' ' PRO . 86.8 p -67.31 -24.2 65.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.157 -0.964 . . . . 0.0 110.12 -178.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 94' ' ' ALA . 81.5 mt -96.99 102.01 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 120.751 -1.218 . . . . 0.0 109.274 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 52.3 p -73.43 -28.04 61.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 108.899 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.4 m -92.04 30.51 1.41 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -61.83 -65.55 0.67 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.287 -0.883 . . . . 0.0 108.684 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.776 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.37 -51.27 35.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 109.178 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.04 -42.71 90.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.976 -1.077 . . . . 0.0 108.756 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 52.2 m -60.99 -40.84 95.03 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.246 -0.909 . . . . 0.0 108.707 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -69.29 -48.18 62.4 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.608 -0.682 . . . . 0.0 109.929 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -65.89 -49.03 69.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.144 -0.973 . . . . 0.0 110.919 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -55.83 -54.73 40.95 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 109.846 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.7 -40.9 98.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.274 -0.891 . . . . 0.0 111.115 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.827 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.78 -41.05 81.24 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.454 -1.404 . . . . 0.0 109.571 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.586 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.1 ttm -53.65 -54.1 42.6 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.426 -0.796 . . . . 0.0 111.552 -178.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -72.0 -54.5 9.72 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.661 -1.275 . . . . 0.0 113.164 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -85.41 -44.59 12.63 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 102' ' ' TYR . 3.0 mt -97.96 -7.69 29.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.315 -1.49 . . . . 0.0 114.231 -175.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.8 t80 -59.87 -38.18 57.48 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 119.84 -1.788 . . . . 0.0 109.209 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 15.8 Cg_exo -67.71 -52.07 0.6 Allowed 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.333 2.022 . . . . 0.0 112.036 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -60.67 -38.45 84.98 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.612 ' CG ' HD12 ' A' ' 116' ' ' LEU . 59.7 tt0 -73.33 -52.2 14.72 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.619 -0.676 . . . . 0.0 109.95 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 73.0 m -71.24 -43.87 66.42 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.475 -0.766 . . . . 0.0 110.888 -178.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -67.77 -47.12 70.07 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.018 -1.051 . . . . 0.0 111.407 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt -74.78 -33.59 62.29 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.99 -1.069 . . . . 0.0 112.145 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.47 -25.13 3.78 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.853 -1.154 . . . . 0.0 111.641 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 60.64 48.76 7.0 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.687 -1.258 . . . . 0.0 110.285 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.612 HD12 ' CG ' ' A' ' 110' ' ' GLU . 18.5 mt -67.1 -33.85 76.35 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.106 -0.996 . . . . 0.0 111.264 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.556 ' OG ' ' N ' ' A' ' 118' ' ' THR . 26.6 t -155.43 -166.62 2.3 Favored 'General case' 0 N--CA 1.496 1.828 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.315 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.556 ' N ' ' OG ' ' A' ' 117' ' ' SER . 69.7 p -130.6 156.76 79.26 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.562 -0.711 . . . . 0.0 110.078 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -51.72 -42.82 54.92 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 121.906 1.737 . . . . 0.0 112.493 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.98 -38.96 93.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.743 -1.223 . . . . 0.0 109.512 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -65.64 -43.57 89.06 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.586 HD21 ' HG3' ' A' ' 103' ' ' MET . 24.8 tp -68.49 -50.49 51.94 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.65 -0.656 . . . . 0.0 110.087 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -57.72 -46.38 84.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.052 -1.03 . . . . 0.0 109.167 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.21 96.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.405 -0.81 . . . . 0.0 109.941 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.463 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.0 -34.92 77.43 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.535 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -65.12 -48.13 84.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.72 -37.57 84.68 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.952 -1.092 . . . . 0.0 108.256 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.41 -33.0 86.07 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.6 p-10 -93.11 -31.77 14.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.797 -1.413 . . . . 0.0 110.267 -179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.6 mtp180 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 120.761 -1.212 . . . . 0.0 109.521 179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.785 ' O ' HG13 ' A' ' 13' ' ' VAL . 24.9 mm-40 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.34 -51.31 70.36 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.175 -0.953 . . . . 0.0 109.388 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -63.29 -44.37 95.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.164 -0.96 . . . . 0.0 109.432 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -66.05 -48.54 70.71 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.881 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.785 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.3 m -69.5 -36.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.727 -1.233 . . . . 0.0 108.603 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -56.7 -39.4 73.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.495 -1.378 . . . . 0.0 107.863 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -58.34 -32.08 68.18 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.456 ' CD1' HD13 ' A' ' 46' ' ' LEU . 8.8 mt -71.35 -40.29 70.78 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.0 111.934 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -75.5 -32.92 60.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.452 -1.405 . . . . 0.0 110.119 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.466 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.4 mt-10 -67.08 -26.15 66.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.995 -1.066 . . . . 0.0 110.48 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.525 HD13 HH21 ' A' ' 25' ' ' ARG . 34.4 mt -38.36 -41.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 121.566 -0.708 . . . . 0.0 110.502 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.443 ' C ' ' OD1' ' A' ' 20' ' ' ASN . 36.5 p30 -172.71 165.65 5.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.873 -1.142 . . . . 0.0 110.309 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -91.1 69.52 6.2 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.663 -0.648 . . . . 0.0 109.63 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -112.19 103.87 55.62 Favored Pre-proline 0 N--CA 1.493 1.695 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -48.62 -42.92 35.19 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.066 1.844 . . . . 0.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -62.54 -38.03 88.44 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.276 -0.89 . . . . 0.0 108.805 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.664 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -60.54 -44.96 95.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.481 -0.762 . . . . 0.0 109.874 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.31 -53.87 48.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.226 -0.921 . . . . 0.0 109.729 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -51.77 -39.76 59.13 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.32 -60.5 3.31 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.425 -0.797 . . . . 0.0 109.933 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' NH1' ' A' ' 25' ' ' ARG . 72.7 mt -54.75 -46.91 74.38 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 109.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.519 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 93.6 m-20 -63.03 -47.34 83.47 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.458 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -67.09 -43.33 82.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.181 -0.949 . . . . 0.0 109.325 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.25 -51.51 69.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.342 -0.849 . . . . 0.0 110.345 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.02 -35.29 74.75 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 117.75 -1.58 . . . . 0.0 107.715 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -69.74 -51.48 33.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.596 -0.69 . . . . 0.0 110.599 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -59.55 -43.92 93.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.245 -0.91 . . . . 0.0 111.92 -178.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.0 mtp -57.38 -31.33 65.69 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 111.268 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -54.13 -40.37 67.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.493 -1.38 . . . . 0.0 108.553 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -65.99 -40.19 90.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.449 -0.782 . . . . 0.0 109.186 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -63.76 -30.69 71.76 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.632 -0.667 . . . . 0.0 110.194 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.57 1.55 68.43 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 107.914 -2.075 . . . . 0.0 107.914 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.1 p -118.8 84.45 25.42 Favored Pre-proline 0 N--CA 1.487 1.411 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.9 146.08 10.23 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.622 2.214 . . . . 0.0 111.397 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 11.7 mt -79.44 95.22 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 119.126 -1.03 . . . . 0.0 109.454 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.59 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 77.5 m-20 -64.4 -43.55 94.09 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -136.42 133.38 36.61 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.456 HD13 ' CD1' ' A' ' 16' ' ' LEU . 7.3 mt -69.98 132.49 88.49 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 120.777 -1.202 . . . . 0.0 108.714 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -58.99 140.11 93.87 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 N-CA-C 108.82 -1.262 . . . . 0.0 108.82 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 mt -106.22 146.02 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.954 -1.091 . . . . 0.0 110.839 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.852 ' SD ' HD13 ' A' ' 54' ' ' LEU . 82.6 mtp -143.54 121.11 11.76 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.18 39.45 1.71 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -178.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt 56.78 22.2 6.73 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.547 0.689 . . . . 0.0 109.576 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.1 m -132.19 150.52 52.14 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -67.65 146.72 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.832 -1.168 . . . . 0.0 108.966 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.852 HD13 ' SD ' ' A' ' 49' ' ' MET . 44.0 tp -74.6 118.06 17.14 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 109.778 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -62.27 93.26 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.327 -0.858 . . . . 0.0 108.95 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -54.09 -26.99 29.98 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.054 -1.029 . . . . 0.0 109.405 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -78.88 -59.34 2.82 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.118 -0.988 . . . . 0.0 111.666 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -57.41 -37.6 73.01 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.502 -1.374 . . . . 0.0 109.519 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.684 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.21 -46.66 87.87 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.479 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 46.2 t80 -61.28 -70.64 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.387 0.613 . . . . 0.0 109.551 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 60' ' ' TYR . 54.3 t30 -38.26 -40.83 0.56 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.657 -0.652 . . . . 0.0 111.01 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.569 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 52.0 mt -72.44 -46.67 53.98 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.356 -1.338 . . . . 0.0 108.277 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 18.9 t -56.37 -43.53 77.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.214 -0.929 . . . . 0.0 110.491 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.479 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.8 mm -70.42 -35.22 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.712 -1.243 . . . . 0.0 108.11 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.68 -19.68 17.7 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.765 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.638 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.3 mmt-85 -94.1 -0.38 55.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.735 -1.228 . . . . 0.0 108.234 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 14.13 80.16 Favored Glycine 0 N--CA 1.492 2.414 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.609 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.47 ' HA2' HD13 ' A' ' 116' ' ' LEU . . . 147.3 126.21 1.66 Allowed Glycine 0 N--CA 1.5 2.935 0 O-C-N 120.065 -1.844 . . . . 0.0 111.582 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.588 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.6 tp -47.33 -41.01 18.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.492 -1.005 . . . . 0.0 109.956 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.3 t -61.42 -42.19 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.031 -1.043 . . . . 0.0 110.197 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -54.98 -37.53 66.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 108.749 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.1 t -65.91 -43.07 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.521 -0.737 . . . . 0.0 110.502 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.9 mt -66.89 -58.65 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.701 -1.249 . . . . 0.0 110.239 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.459 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 96.3 m-20 -58.64 -40.75 84.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.157 -0.964 . . . . 0.0 110.544 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.4 mmtp -92.64 -10.2 38.21 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.157 -0.964 . . . . 0.0 110.614 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 72' ' ' VAL . 49.5 mttp 58.69 56.96 3.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.519 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.46 15.72 10.2 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.837 -1.164 . . . . 0.0 108.12 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.52 ' NE1' HG12 ' A' ' 72' ' ' VAL . 92.9 m95 -65.14 -40.82 94.95 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.447 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.0 mm-40 -49.06 -38.43 24.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.192 -1.403 . . . . 0.0 107.995 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.638 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.0 mt-10 -69.14 -40.86 77.98 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.498 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.9 mt -71.67 -52.48 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.637 HD11 ' HB2' ' A' ' 95' ' ' ALA . 83.8 mt -51.85 -53.75 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.633 -0.667 . . . . 0.0 110.115 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 79' ' ' GLN . 59.9 mttp -70.88 -37.56 73.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.77 -1.206 . . . . 0.0 110.019 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -54.96 -33.7 57.18 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.264 -1.535 . . . . 0.0 109.264 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.2 mt -86.7 -10.54 53.48 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.4 -1.059 . . . . 0.0 108.566 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 67.78 40.66 2.37 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.34 0.59 . . . . 0.0 110.513 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.72 141.55 79.31 Favored Pre-proline 0 N--CA 1.487 1.405 0 O-C-N 121.157 -0.964 . . . . 0.0 108.634 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.559 ' C ' ' H ' ' A' ' 90' ' ' SER . 39.8 Cg_endo -71.59 142.03 39.31 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 121.979 1.786 . . . . 0.0 112.076 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.0 p -55.73 0.01 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.559 ' H ' ' C ' ' A' ' 88' ' ' PRO . 20.4 m -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.077 -1.015 . . . . 0.0 109.937 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.3 mt -92.86 101.57 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 120.781 -1.199 . . . . 0.0 109.258 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -71.26 -29.53 65.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.226 -0.921 . . . . 0.0 109.179 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 50.3 m -96.32 40.07 1.14 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.46 -0.775 . . . . 0.0 109.472 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -62.6 1.51 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.945 . . . . 0.0 108.721 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.637 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.6 -51.06 22.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.289 -0.882 . . . . 0.0 109.694 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.409 HD12 HH21 ' A' ' 99' ' ' ARG . 7.1 tp -58.53 -41.22 85.0 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.603 -1.31 . . . . 0.0 108.61 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.623 HG22 HE22 ' A' ' 101' ' ' GLN . 35.8 m -63.87 -41.31 97.78 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.272 -0.893 . . . . 0.0 109.271 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.423 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -68.49 -46.35 69.92 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.266 -0.896 . . . . 0.0 110.692 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.752 ' NH1' HD21 ' A' ' 129' ' ' ASN . 34.6 ttp180 -68.17 -48.57 64.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.137 -0.977 . . . . 0.0 110.833 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.9 m -55.54 -53.54 55.13 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.058 -1.026 . . . . 0.0 110.017 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.623 HE22 HG22 ' A' ' 97' ' ' THR . 8.4 mt-30 -64.68 -41.19 96.23 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.954 -1.091 . . . . 0.0 111.548 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.3 t80 -57.23 -41.98 80.56 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 120.317 -1.489 . . . . 0.0 109.007 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.697 ' HG2' HD21 ' A' ' 122' ' ' LEU . 83.1 mtp -54.24 -57.69 10.23 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-O 121.471 0.653 . . . . 0.0 112.246 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -71.17 -51.47 24.67 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.414 -1.429 . . . . 0.0 112.099 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' HD12 ' A' ' 106' ' ' LEU . 60.6 m-85 -84.67 -46.14 11.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -175.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.9 mp -103.13 11.97 36.41 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.355 -1.466 . . . . 0.0 113.835 -176.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.541 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.5 t80 -68.79 -38.4 11.65 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 119.903 -1.748 . . . . 0.0 111.492 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 86.9 Cg_endo -79.1 -41.57 0.22 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.535 1.49 . . . . 0.0 112.514 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -58.47 -41.92 86.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.856 -1.152 . . . . 0.0 107.975 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.492 ' CG ' HD12 ' A' ' 116' ' ' LEU . 61.3 tt0 -70.65 -49.58 45.9 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.443 0.64 . . . . 0.0 110.213 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.516 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.5 t -74.82 -44.43 49.33 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.379 -0.826 . . . . 0.0 110.675 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.0 tp10 -66.4 -46.05 77.93 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.347 -0.846 . . . . 0.0 111.061 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -75.08 -33.2 61.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.039 -1.038 . . . . 0.0 111.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.02 -25.18 3.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.844 -1.16 . . . . 0.0 112.133 -177.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.0 t-20 59.26 50.7 7.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.579 -1.326 . . . . 0.0 110.506 178.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.492 HD12 ' CG ' ' A' ' 110' ' ' GLU . 26.2 mt -68.37 -32.17 72.06 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.346 -0.847 . . . . 0.0 111.839 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 10.0 t -154.66 -167.02 2.48 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 118.465 -1.294 . . . . 0.0 111.502 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.7 p -123.77 160.3 52.02 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 121.771 -0.58 . . . . 0.0 109.574 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -59.98 -38.69 76.75 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.348 1.365 . . . . 0.0 112.007 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.56 86.71 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.987 -1.071 . . . . 0.0 109.561 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.25 -48.37 67.95 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.697 HD21 ' HG2' ' A' ' 103' ' ' MET . 39.8 tp -63.22 -53.2 56.85 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.486 -0.759 . . . . 0.0 109.92 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -57.76 -44.33 86.09 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.002 -1.061 . . . . 0.0 109.235 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.18 91.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.738 . . . . 0.0 111.074 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.459 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -69.2 -32.08 71.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.027 -1.046 . . . . 0.0 109.17 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.684 ' CG2' ' NH2' ' A' ' 130' ' ' ARG . 12.0 mt -63.58 -49.42 82.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.001 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.17 -35.93 78.82 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.45 -17.9 67.04 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.752 HD21 ' NH1' ' A' ' 99' ' ' ARG . 17.2 p-10 -94.3 -30.58 14.46 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.842 -1.387 . . . . 0.0 110.644 -179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.684 ' NH2' ' CG2' ' A' ' 126' ' ' ILE . 1.1 mtt-85 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 120.65 -1.281 . . . . 0.0 110.112 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.969 ' O ' HG12 ' A' ' 13' ' ' VAL . 20.5 mm-40 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 120.883 0.373 . . . . 0.0 110.046 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.02 -46.67 84.91 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.291 -0.881 . . . . 0.0 109.826 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -62.27 -43.69 98.25 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.009 -1.057 . . . . 0.0 109.54 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -65.91 -50.21 65.25 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.457 -0.777 . . . . 0.0 111.09 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.969 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.2 p -68.15 -39.02 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.705 -1.247 . . . . 0.0 109.455 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.52 -38.35 87.06 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.274 -1.516 . . . . 0.0 107.757 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.422 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.0 OUTLIER -56.22 -32.41 64.42 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.085 -1.046 . . . . 0.0 108.179 178.249 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.483 ' HB3' HD13 ' A' ' 29' ' ' LEU . 6.5 mt -66.85 -41.2 87.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.316 -0.865 . . . . 0.0 111.734 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -75.7 -36.59 59.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.363 -1.461 . . . . 0.0 109.88 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -70.3 -3.86 19.27 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.072 -1.018 . . . . 0.0 110.97 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.652 HG21 ' NH1' ' A' ' 25' ' ' ARG . 8.9 mt -56.66 -41.42 74.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 O-C-N 121.236 -0.915 . . . . 0.0 109.467 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -171.85 166.41 6.43 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.058 -1.026 . . . . 0.0 110.397 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.496 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.9 p30 -89.22 67.27 7.86 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.641 -0.662 . . . . 0.0 110.835 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.43 ' C ' ' OD1' ' A' ' 22' ' ' ASP . 8.8 t0 -112.17 95.41 30.15 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.12 -41.65 33.65 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 122.207 1.938 . . . . 0.0 112.794 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -62.56 -40.03 95.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.908 -1.12 . . . . 0.0 108.752 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.652 ' NH1' HG21 ' A' ' 19' ' ' ILE . 63.1 ttt180 -59.69 -36.12 75.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 110.11 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -60.15 -52.94 63.17 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.403 -0.811 . . . . 0.0 109.354 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -52.65 -38.3 60.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.471 -0.768 . . . . 0.0 109.971 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -64.48 -59.74 3.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.081 -1.012 . . . . 0.0 110.81 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.483 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.7 mt -52.93 -47.91 67.7 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.041 -1.037 . . . . 0.0 108.791 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -61.93 -45.14 95.01 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.418 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.1 -46.73 73.33 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.218 -0.926 . . . . 0.0 109.843 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.5 tp -57.21 -47.78 80.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.224 -0.922 . . . . 0.0 110.276 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CE2' HG23 ' A' ' 13' ' ' VAL . 47.7 m-85 -61.89 -36.6 81.78 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.19 -1.404 . . . . 0.0 107.679 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -70.24 -53.12 18.31 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.564 -0.71 . . . . 0.0 109.975 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 74.6 t80 -59.2 -42.08 90.06 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.375 -0.828 . . . . 0.0 111.172 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mmm -57.23 -34.85 68.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.944 . . . . 0.0 110.443 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -54.63 -39.92 68.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 109.362 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -74.89 -30.21 61.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 108.793 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 14.6 mmm180 -65.72 -30.85 71.58 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.742 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.93 -0.63 69.78 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.5 p -116.68 84.48 15.4 Favored Pre-proline 0 N--CA 1.488 1.468 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -83.14 139.03 9.25 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 122.558 2.172 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.9 mt -73.75 96.76 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.091 -1.005 . . . . 0.0 110.246 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 81.9 m-20 -60.52 -33.99 73.44 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -158.98 139.24 12.24 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.462 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.92 125.37 92.0 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.032 -1.043 . . . . 0.0 110.157 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -53.21 139.52 62.99 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.7 mt -103.11 146.7 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.867 -1.146 . . . . 0.0 110.714 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 73.2 mmm -137.41 127.06 25.27 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 56.85 42.89 25.83 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.93 24.51 12.64 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.365 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -135.05 153.84 51.92 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.182 -0.949 . . . . 0.0 109.324 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.2 m -67.27 142.09 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 120.983 -1.073 . . . . 0.0 109.387 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 HD22 ' A' ' 59' ' ' LEU . 64.8 tp -75.16 123.48 25.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.307 -0.871 . . . . 0.0 110.012 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.595 ' CG ' HH22 ' A' ' 25' ' ' ARG . 38.5 m-20 -59.56 99.96 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.521 -0.737 . . . . 0.0 109.719 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.6 -30.32 71.25 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.074 -1.016 . . . . 0.0 109.234 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -80.85 -60.56 2.26 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.291 -0.881 . . . . 0.0 111.578 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -54.1 -38.16 65.07 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.666 -1.271 . . . . 0.0 108.584 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.639 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.95 -46.37 89.64 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.441 ' CE2' HG13 ' A' ' 64' ' ' ILE . 54.0 t80 -59.37 -66.38 0.52 Allowed 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 121.485 0.659 . . . . 0.0 109.731 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -42.92 -42.11 3.59 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.582 -0.699 . . . . 0.0 111.552 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.99 -43.63 64.78 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.059 -1.456 . . . . 0.0 108.066 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 36.1 t -58.98 -44.35 90.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.239 -0.913 . . . . 0.0 109.334 179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.441 HG13 ' CE2' ' A' ' 60' ' ' TYR . 15.7 mm -69.55 -38.72 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 120.738 -1.226 . . . . 0.0 108.403 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.89 -19.93 7.7 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.812 -0.555 . . . . 0.0 110.13 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.553 ' CG ' HD13 ' A' ' 77' ' ' LEU . 7.0 mpt_? -95.06 -0.82 53.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.584 -1.323 . . . . 0.0 108.957 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.63 72.56 Favored Glycine 0 N--CA 1.492 2.404 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.263 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.1 131.52 2.46 Favored Glycine 0 N--CA 1.498 2.806 0 CA-C-N 119.722 1.761 . . . . 0.0 111.703 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.485 HD11 ' CH2' ' A' ' 78' ' ' TRP . 20.1 tp -52.64 -38.97 61.27 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.678 -0.895 . . . . 0.0 109.738 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 77.8 t -56.15 -43.64 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.202 -0.936 . . . . 0.0 108.97 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -59.15 -40.2 84.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.166 -0.959 . . . . 0.0 110.025 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.595 ' O ' ' N ' ' A' ' 76' ' ' LYS . 60.5 t -63.64 -43.99 98.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 120.741 -1.224 . . . . 0.0 109.551 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 33.7 mt -65.04 -61.53 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 120.758 -1.214 . . . . 0.0 110.182 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -58.48 -41.38 85.17 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.156 -0.965 . . . . 0.0 110.764 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -10.03 44.13 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.95 -1.093 . . . . 0.0 110.261 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' VAL . 21.4 mtmm 58.69 60.66 2.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.29 -0.881 . . . . 0.0 110.951 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.553 HD13 ' CG ' ' A' ' 66' ' ' ARG . 13.0 mt -95.42 14.22 23.32 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.104 -0.998 . . . . 0.0 108.55 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' A' ' 82' ' ' ILE . 98.8 m95 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.36 -0.837 . . . . 0.0 109.03 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.445 ' C ' ' O ' ' A' ' 78' ' ' TRP . 80.5 mt-30 -48.13 -38.83 18.77 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.537 -1.352 . . . . 0.0 108.437 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.8 mm-40 -67.85 -38.61 83.35 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 178.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.3 mt -74.25 -51.41 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.68 HD11 ' HB2' ' A' ' 95' ' ' ALA . 57.3 mt -52.0 -56.05 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.49 -37.07 68.53 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.374 -0.829 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -51.85 -34.7 37.96 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.49 -4.92 55.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.373 -1.075 . . . . 0.0 109.039 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 65.72 38.98 5.01 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.642 0.734 . . . . 0.0 109.16 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.24 145.75 86.03 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.411 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.0 Cg_endo -71.06 136.68 30.11 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.281 1.987 . . . . 0.0 112.415 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 t -62.79 -0.7 0.7 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 88' ' ' PRO . 77.9 p -64.64 -25.56 68.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.987 -1.07 . . . . 0.0 109.551 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.25 99.5 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.99 -1.069 . . . . 0.0 108.748 178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 40.8 p -68.35 -31.12 70.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.108 -0.995 . . . . 0.0 108.851 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -88.07 29.25 0.96 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.23 -67.35 0.38 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.4 -0.813 . . . . 0.0 108.976 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.03 -47.54 33.51 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.644 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 tp -59.8 -45.53 92.06 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.33 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 36.2 m -61.63 -39.75 92.41 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.02 -1.05 . . . . 0.0 108.616 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.8 mt -70.9 -43.99 67.19 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.509 -0.745 . . . . 0.0 109.725 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HA ' ' CH2' ' A' ' 78' ' ' TRP . 3.6 tmm_? -66.24 -51.28 59.09 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.111 -0.993 . . . . 0.0 110.66 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.2 m -57.11 -54.69 43.91 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.552 -0.718 . . . . 0.0 110.996 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -62.61 -41.2 98.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.986 -1.071 . . . . 0.0 111.393 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.9 t80 -57.32 -41.63 80.29 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.545 -1.347 . . . . 0.0 109.344 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.712 ' CE ' HD11 ' A' ' 126' ' ' ILE . 35.3 ttm -53.81 -52.89 58.88 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.823 -0.548 . . . . 0.0 111.313 -178.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -71.17 -54.84 9.62 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.811 -1.181 . . . . 0.0 112.732 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.467 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -84.86 -45.8 11.94 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -174.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.646 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.4 mp -97.4 -7.74 31.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.121 -1.612 . . . . 0.0 114.255 -175.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.634 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 26.6 t80 -57.94 -38.3 65.2 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 119.822 -1.799 . . . . 0.0 110.006 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 24.4 Cg_exo -65.0 -54.43 0.66 Allowed 'Trans proline' 0 N--CA 1.5 1.881 0 C-N-CA 122.513 2.142 . . . . 0.0 112.793 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.23 -44.07 88.04 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.178 -0.951 . . . . 0.0 108.64 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.33 -53.95 30.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 110.502 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.634 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 58.0 m -71.62 -45.09 63.11 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -0.868 . . . . 0.0 111.456 -177.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -67.67 -49.44 62.82 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.912 -1.117 . . . . 0.0 111.268 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -76.76 -23.79 52.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.995 -1.065 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.419 ' HG2' HD21 ' A' ' 116' ' ' LEU . 15.1 tptp -125.88 -30.96 2.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.81 -1.181 . . . . 0.0 111.416 -177.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 111' ' ' CYS . 15.3 t30 56.32 47.02 19.96 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.92 -1.113 . . . . 0.0 110.226 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.419 HD21 ' HG2' ' A' ' 114' ' ' LYS . 48.5 mt -67.64 -30.28 69.8 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.003 -1.06 . . . . 0.0 111.114 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 32.1 t -153.94 -166.64 2.43 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.371 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 64.0 p -126.79 153.66 75.92 Favored Pre-proline 0 N--CA 1.497 1.903 0 O-C-N 121.711 -0.618 . . . . 0.0 109.984 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -52.08 -40.54 68.05 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.121 1.881 . . . . 0.0 112.188 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.27 89.35 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.769 -1.207 . . . . 0.0 109.727 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -65.84 -42.94 89.86 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.6 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.1 tp -65.69 -53.59 38.92 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.576 -0.702 . . . . 0.0 109.937 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.629 ' HA ' HD12 ' A' ' 126' ' ' ILE . 68.3 tp60 -56.05 -44.37 78.78 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.55 75.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.54 -36.12 73.51 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.752 0.786 . . . . 0.0 108.954 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.712 HD11 ' CE ' ' A' ' 103' ' ' MET . 34.0 mt -59.05 -52.89 55.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -67.0 -37.7 84.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.509 -0.744 . . . . 0.0 109.327 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.15 -30.11 72.89 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.698 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -95.82 -36.36 11.16 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.916 -1.344 . . . . 0.0 110.505 -178.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.698 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.7 mtp180 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 120.85 -1.156 . . . . 0.0 110.295 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.888 ' O ' HG12 ' A' ' 13' ' ' VAL . 20.0 mm-40 . . . . . 0 N--CA 1.487 1.415 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -55.15 -49.4 71.92 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.363 -0.836 . . . . 0.0 109.62 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -61.6 -38.73 88.68 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.92 -1.113 . . . . 0.0 109.176 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -65.21 -52.56 53.94 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.482 -0.761 . . . . 0.0 111.13 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.888 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -70.53 -35.95 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.989 -1.069 . . . . 0.0 109.62 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -60.05 -38.73 83.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.305 -1.497 . . . . 0.0 107.894 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.433 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.4 OUTLIER -58.93 -31.87 69.05 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 178.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.9 mt -67.44 -36.41 81.16 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.436 -0.79 . . . . 0.0 110.964 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.417 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 81.5 m-85 -82.32 -38.62 24.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.375 -1.453 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.6 -30.25 71.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.067 -1.021 . . . . 0.0 111.032 -177.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 16' ' ' LEU . 8.1 mt -38.02 -37.08 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 O-C-N 121.567 -0.708 . . . . 0.0 110.363 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.3 m120 -170.31 159.68 7.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.952 -1.093 . . . . 0.0 109.78 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.2 64.82 4.56 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.736 -0.603 . . . . 0.0 109.525 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.94 137.55 20.15 Favored Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -71.81 -61.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.029 1.819 . . . . 0.0 112.198 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -59.35 -37.84 78.89 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.224 -0.923 . . . . 0.0 109.649 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.482 ' NH2' HG21 ' A' ' 19' ' ' ILE . 57.0 ttt180 -56.84 -42.39 79.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.646 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -60.9 -54.23 47.65 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.154 -0.966 . . . . 0.0 108.834 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -53.42 -36.17 61.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.591 -0.693 . . . . 0.0 109.633 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -61.42 -62.91 1.49 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.344 -0.847 . . . . 0.0 110.816 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.632 HD22 HD13 ' A' ' 16' ' ' LEU . 16.4 mt -57.13 -44.45 83.36 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.515 -0.741 . . . . 0.0 109.55 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.417 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 30.6 m-20 -63.4 -45.9 88.9 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.352 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -66.43 -42.37 87.82 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.114 -0.991 . . . . 0.0 109.008 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.97 -50.51 73.15 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.322 -0.861 . . . . 0.0 110.169 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -60.83 -34.08 74.01 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 117.988 -1.485 . . . . 0.0 107.971 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.5 m -68.88 -50.16 52.06 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.092 -1.005 . . . . 0.0 108.942 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.1 -43.27 95.7 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 111.103 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.7 mmm -58.22 -35.79 72.18 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.229 -0.92 . . . . 0.0 110.84 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -59.19 -40.33 85.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.695 -1.253 . . . . 0.0 108.853 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -64.73 -40.91 96.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.332 -0.855 . . . . 0.0 109.396 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -65.2 -30.11 70.98 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.898 -0.501 . . . . 0.0 110.412 -178.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 1.13 64.63 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 107.775 -2.13 . . . . 0.0 107.775 -178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.4 p -116.56 85.23 16.22 Favored Pre-proline 0 N--CA 1.488 1.434 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -83.53 148.47 12.72 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.733 2.289 . . . . 0.0 111.716 -179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.53 HG21 HD23 ' A' ' 46' ' ' LEU . 46.0 mt -87.52 101.42 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.037 -1.039 . . . . 0.0 110.195 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.562 ' C ' ' NE2' ' A' ' 9' ' ' GLN . 84.9 m-20 -85.95 -0.77 56.31 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.311 -0.868 . . . . 0.0 109.026 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.6 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -171.79 120.23 0.46 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.507 -0.745 . . . . 0.0 109.206 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.53 HD23 HG21 ' A' ' 43' ' ' ILE . 14.0 mt -72.09 118.9 71.21 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.054 -1.029 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.438 ' HB3' ' NE2' ' A' ' 101' ' ' GLN . 48.3 Cg_exo -49.72 128.29 20.94 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 N-CA-C 108.831 -1.257 . . . . 0.0 108.831 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.502 HG23 ' N ' ' A' ' 52' ' ' SER . 60.4 mt -95.71 144.19 10.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.134 -0.979 . . . . 0.0 110.608 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.71 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.4 mtp -135.09 122.1 21.26 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.87 39.83 3.27 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -178.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 58.6 24.4 12.0 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.252 0.549 . . . . 0.0 110.247 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.502 ' N ' HG23 ' A' ' 48' ' ' ILE . 78.2 p -136.64 152.75 50.77 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.189 -0.945 . . . . 0.0 109.445 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.9 m -67.39 144.99 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 120.973 -1.079 . . . . 0.0 109.216 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.71 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.3 tp -74.16 120.49 19.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 110.028 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -63.05 91.8 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.341 -0.85 . . . . 0.0 109.09 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.06 -26.22 59.99 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.145 -0.972 . . . . 0.0 110.096 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.444 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 44.3 t80 -81.02 -57.03 3.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.066 -1.021 . . . . 0.0 111.586 -178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.43 -37.87 79.21 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.564 -1.335 . . . . 0.0 109.411 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.629 HD22 HD21 ' A' ' 54' ' ' LEU . 65.3 tp -59.83 -45.99 90.65 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CE2' HG13 ' A' ' 64' ' ' ILE . 43.3 t80 -57.26 -66.64 0.42 Allowed 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.522 0.677 . . . . 0.0 109.41 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 74.6 m-20 -41.43 -41.13 1.94 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.689 -0.632 . . . . 0.0 111.219 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.44 -43.14 64.2 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 118.234 -1.386 . . . . 0.0 107.689 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 43.7 t -59.39 -44.75 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.874 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.413 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -69.51 -36.86 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.663 -1.273 . . . . 0.0 108.318 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.403 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.1 -22.81 11.88 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.848 -0.533 . . . . 0.0 110.27 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.517 ' CG ' HD13 ' A' ' 77' ' ' LEU . 9.0 mpt_? -92.93 -0.22 57.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.614 -1.304 . . . . 0.0 108.753 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.98 17.99 68.55 Favored Glycine 0 N--CA 1.49 2.252 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.818 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 141.24 129.38 2.48 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 120.548 -1.56 . . . . 0.0 111.259 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.55 HD11 ' CH2' ' A' ' 78' ' ' TRP . 15.6 tp -50.36 -40.64 49.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.677 -0.896 . . . . 0.0 110.361 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.2 t -57.75 -42.14 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.861 -1.149 . . . . 0.0 109.871 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -55.94 -40.12 72.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.914 -1.116 . . . . 0.0 108.909 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 94.0 t -65.06 -41.29 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 110.157 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.47 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 49.3 mt -67.59 -56.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 O-C-N 120.775 -1.203 . . . . 0.0 109.734 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -57.69 -42.03 82.84 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.136 -0.977 . . . . 0.0 110.184 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -92.23 -10.21 39.38 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.253 -0.904 . . . . 0.0 110.452 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 3.5 mtmp? 58.54 59.08 3.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.385 -0.822 . . . . 0.0 110.05 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 15.37 11.46 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.014 -1.054 . . . . 0.0 108.545 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.734 ' HE1' HH12 ' A' ' 99' ' ' ARG . 99.0 m95 -63.26 -37.56 87.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 108.923 178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.548 ' NE2' ' H ' ' A' ' 79' ' ' GLN . 3.6 mp0 -48.9 -40.82 31.35 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.439 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HB3' HH21 ' A' ' 66' ' ' ARG . 81.3 mm-40 -69.05 -38.85 79.34 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt -71.28 -53.46 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.718 HD11 ' HB2' ' A' ' 95' ' ' ALA . 76.3 mt -53.19 -52.83 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -73.58 -40.29 64.0 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.292 -0.88 . . . . 0.0 109.889 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.05 -34.18 46.06 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' C ' ' CD2' ' A' ' 86' ' ' HIS . 87.7 mt -88.48 -7.2 56.94 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.287 -1.125 . . . . 0.0 108.886 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.448 ' CD2' ' C ' ' A' ' 85' ' ' LEU . 12.8 m-70 69.15 36.67 2.34 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.576 0.703 . . . . 0.0 109.245 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -73.3 121.01 84.06 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.359 -0.838 . . . . 0.0 109.198 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 90' ' ' SER . 45.9 Cg_exo -50.08 139.62 34.06 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.669 1.579 . . . . 0.0 112.23 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 p -63.44 0.87 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 109.619 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 88' ' ' PRO . 89.1 p -65.04 -24.49 67.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.935 -178.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 50' ' ' ALA . 86.6 mt -95.72 98.43 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.948 -1.095 . . . . 0.0 108.894 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 30.6 p -68.36 -28.51 67.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -0.92 . . . . 0.0 108.803 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.8 m -90.5 30.54 1.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.26 -65.9 0.62 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.855 . . . . 0.0 108.986 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.718 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.92 -50.7 33.95 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 109.179 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.03 -45.66 86.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.851 -1.156 . . . . 0.0 108.978 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.9 m -60.67 -40.02 90.56 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.174 -0.954 . . . . 0.0 108.845 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.5 mt -72.56 -44.49 62.02 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.452 -0.78 . . . . 0.0 110.152 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.734 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.6 ttm-85 -65.99 -52.86 45.65 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.176 -0.953 . . . . 0.0 110.739 -179.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.1 m -57.05 -52.73 64.11 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.43 -0.794 . . . . 0.0 110.778 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.438 ' NE2' ' HB3' ' A' ' 47' ' ' PRO . 86.6 mt-30 -62.34 -40.67 97.13 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.127 -0.983 . . . . 0.0 111.142 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.4 t80 -57.92 -39.49 78.1 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 120.55 -1.344 . . . . 0.0 109.038 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.538 ' HG3' HD21 ' A' ' 122' ' ' LEU . 2.9 ttm -53.96 -56.49 17.34 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.548 -0.72 . . . . 0.0 111.877 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -72.42 -52.18 17.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.479 -1.388 . . . . 0.0 113.032 -176.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.428 ' C ' HD12 ' A' ' 106' ' ' LEU . 62.6 m-85 -85.33 -50.96 6.9 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.629 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -96.52 6.05 49.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.338 -1.476 . . . . 0.0 113.751 -176.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.598 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 78.0 t80 -68.42 -37.15 9.83 Favored Pre-proline 0 C--N 1.3 -1.545 0 O-C-N 120.013 -1.68 . . . . 0.0 111.666 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.1 Cg_endo -80.28 -39.52 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.333 1.356 . . . . 0.0 111.688 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.47 -39.84 84.99 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -72.68 -53.91 10.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.482 -0.761 . . . . 0.0 109.909 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.59 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.8 t -70.56 -44.25 67.81 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.294 -0.879 . . . . 0.0 110.739 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.447 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 43.3 tp10 -66.79 -47.87 70.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 120.759 -1.213 . . . . 0.0 110.851 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -75.97 -28.17 57.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 111.158 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HG2' HD21 ' A' ' 116' ' ' LEU . 44.3 tptt -125.32 -26.55 3.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.064 -1.022 . . . . 0.0 111.811 -177.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.5 OUTLIER 57.72 45.67 18.5 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.644 -1.285 . . . . 0.0 110.048 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.462 HD21 ' HG2' ' A' ' 114' ' ' LYS . 75.6 mt -68.4 -32.61 72.79 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.203 -0.935 . . . . 0.0 110.958 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.505 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 42.9 t -155.79 -166.93 2.34 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.633 -1.227 . . . . 0.0 111.94 -178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.456 ' C ' ' OH ' ' A' ' 107' ' ' TYR . 70.5 p -120.55 153.65 56.53 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -179.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.598 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 14.7 Cg_endo -59.35 -38.17 86.09 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.876 1.717 . . . . 0.0 112.186 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.07 85.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.051 -1.031 . . . . 0.0 109.319 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.505 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.9 mt-10 -66.81 -42.73 85.4 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.538 HD21 ' HG3' ' A' ' 103' ' ' MET . 11.5 tp -64.74 -52.85 54.87 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 109.431 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -57.89 -46.43 84.92 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.201 -0.937 . . . . 0.0 109.065 178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.8 -42.72 98.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.38 -0.825 . . . . 0.0 110.152 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.53 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.061 -1.024 . . . . 0.0 108.342 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 4.1 mt -65.47 -49.25 79.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 130' ' ' ARG . 89.8 m-20 -61.09 -38.3 85.78 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.66 -30.87 78.1 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.702 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.0 OUTLIER -90.59 -34.28 15.55 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.981 -1.305 . . . . 0.0 110.902 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.66 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 67.6 mtm180 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 120.625 -1.297 . . . . 0.0 109.513 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.818 ' O ' HG12 ' A' ' 13' ' ' VAL . 2.9 mm-40 . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.3 -49.57 66.72 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.88 . . . . 0.0 109.768 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -61.56 -37.61 84.47 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.162 -0.961 . . . . 0.0 109.275 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -65.77 -53.32 42.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.166 -0.959 . . . . 0.0 110.956 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.818 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -72.76 -36.16 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.995 -1.066 . . . . 0.0 109.707 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -60.99 -40.99 95.57 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.261 -1.524 . . . . 0.0 108.421 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -59.05 -30.73 68.26 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.231 -0.918 . . . . 0.0 108.733 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.63 ' HA ' HD12 ' A' ' 19' ' ' ILE . 12.0 mt -67.31 -33.88 76.19 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.922 178.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -83.96 -40.9 17.91 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.636 -1.29 . . . . 0.0 110.723 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.8 mm-40 -57.42 -32.23 66.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.054 -1.029 . . . . 0.0 109.322 -177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 16' ' ' LEU . 5.2 mt -44.62 -43.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 O-C-N 121.423 -0.798 . . . . 0.0 109.721 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 3.9 m120 -178.04 123.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.123 -0.986 . . . . 0.0 109.781 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.495 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 51.6 p30 -86.1 68.78 10.4 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.554 -0.716 . . . . 0.0 110.789 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.4 130.94 39.84 Favored Pre-proline 0 C--N 1.303 -1.414 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -40.08 -64.16 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 C-N-CA 122.118 1.879 . . . . 0.0 112.984 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -63.89 -39.26 93.78 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.705 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.547 ' NH2' HG21 ' A' ' 19' ' ' ILE . 58.7 ttt180 -59.78 -45.99 90.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.845 -1.16 . . . . 0.0 110.38 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -61.0 -47.46 86.34 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.829 -1.17 . . . . 0.0 108.697 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.514 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 84.9 tt0 -53.03 -27.68 20.8 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.389 0.614 . . . . 0.0 109.784 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -71.89 -61.68 1.7 Allowed 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.114 -0.991 . . . . 0.0 111.33 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 16' ' ' LEU . 13.6 mt -60.27 -44.68 95.11 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.383 -0.823 . . . . 0.0 111.057 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.589 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 40.9 p-10 -64.37 -46.02 85.17 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 118.931 -1.107 . . . . 0.0 109.579 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.589 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 52.5 t0 -65.74 -43.54 88.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.289 -0.882 . . . . 0.0 109.445 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -54.63 -49.09 71.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.188 -0.945 . . . . 0.0 109.578 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.522 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 51.5 m-85 -62.1 -34.62 76.67 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.75 -1.18 . . . . 0.0 107.856 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -69.3 -55.41 10.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.536 -0.728 . . . . 0.0 110.44 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 39.2 t80 -60.52 -38.3 83.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.282 -0.886 . . . . 0.0 110.929 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.4 mmm -60.15 -36.21 77.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.007 . . . . 0.0 110.946 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -57.91 -41.2 82.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.052 . . . . 0.0 110.335 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -65.01 -37.78 88.78 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.644 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -64.48 -30.11 71.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.837 -178.637 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.36 1.21 64.59 Favored Glycine 0 N--CA 1.482 1.742 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 41.9 p -114.43 84.3 9.5 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -85.11 143.16 9.01 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.514 2.143 . . . . 0.0 110.767 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 46' ' ' LEU . 53.5 mt -80.68 99.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 120.944 -1.098 . . . . 0.0 110.008 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 80.9 m-20 -64.48 -46.83 81.35 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -138.22 133.2 32.9 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 43' ' ' ILE . 9.5 mt -70.69 147.47 94.5 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 120.84 -1.163 . . . . 0.0 109.182 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.33 106.64 1.8 Allowed 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 121.556 1.504 . . . . 0.0 109.875 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.524 HG23 ' N ' ' A' ' 52' ' ' SER . 40.6 mt -77.15 142.55 14.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.131 -0.98 . . . . 0.0 109.947 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.746 ' SD ' HG21 ' A' ' 97' ' ' THR . 69.0 mmm -134.08 127.08 31.45 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 59.87 42.6 16.17 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 59.65 25.61 14.57 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.205 0.526 . . . . 0.0 110.409 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.524 ' N ' HG23 ' A' ' 48' ' ' ILE . 95.3 p -138.02 153.53 49.37 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.129 -0.982 . . . . 0.0 109.758 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.2 m -66.88 145.07 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.027 -1.046 . . . . 0.0 109.178 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 HD22 ' A' ' 59' ' ' LEU . 46.1 tp -79.7 125.31 29.48 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.366 -0.834 . . . . 0.0 109.999 -179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.555 ' OD1' HD13 ' A' ' 19' ' ' ILE . 84.1 m-20 -68.35 89.6 0.34 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.404 -0.81 . . . . 0.0 109.301 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -52.03 -22.68 4.27 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.313 -0.867 . . . . 0.0 109.595 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.545 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 48.7 t80 -77.72 -55.38 5.39 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.06 -1.025 . . . . 0.0 111.66 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -61.81 -39.94 93.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.765 -1.209 . . . . 0.0 110.44 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.49 HD13 HD22 ' A' ' 98' ' ' LEU . 52.6 tp -59.55 -43.45 93.52 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 120.732 -1.23 . . . . 0.0 108.263 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.435 ' CE2' HG13 ' A' ' 64' ' ' ILE . 50.2 t80 -59.29 -66.75 0.46 Allowed 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.484 0.659 . . . . 0.0 109.653 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 71.8 m-20 -42.54 -39.48 2.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.61 -0.681 . . . . 0.0 110.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.47 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.6 mt -72.5 -44.74 61.84 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.448 -1.301 . . . . 0.0 107.851 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.8 t -58.8 -45.49 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.135 -0.978 . . . . 0.0 110.16 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.435 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.7 mm -67.72 -35.5 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.681 -1.262 . . . . 0.0 108.412 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.481 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.85 -25.15 26.79 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 120.261 -0.575 . . . . 0.0 110.073 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.586 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.8 mpt_? -91.17 -2.79 57.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.574 -1.329 . . . . 0.0 108.953 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.74 18.72 61.1 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.14 178.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.417 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 137.68 133.6 3.15 Favored Glycine 0 N--CA 1.501 3.031 0 CA-C-N 119.297 1.548 . . . . 0.0 111.41 178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' HH2' ' A' ' 78' ' ' TRP . 11.9 tp -51.13 -39.01 55.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.727 -0.866 . . . . 0.0 110.305 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.94 -43.3 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.037 -1.04 . . . . 0.0 109.543 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -58.05 -39.57 78.8 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.991 -1.068 . . . . 0.0 110.171 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 76' ' ' LYS . 52.2 t -64.13 -43.58 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.38 -0.825 . . . . 0.0 110.291 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.403 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 80.8 mt -66.03 -57.92 8.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 O-C-N 120.655 -1.278 . . . . 0.0 110.249 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -58.26 -41.34 84.05 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.174 -0.954 . . . . 0.0 110.415 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -92.61 -9.09 42.29 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.144 -0.973 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.0 mttp 57.67 57.3 4.34 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 -178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.539 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.7 mt -90.71 15.48 11.0 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 120.951 -1.093 . . . . 0.0 108.244 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.611 ' HH2' HD11 ' A' ' 69' ' ' LEU . 91.4 m95 -65.69 -40.27 92.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.5 -0.75 . . . . 0.0 109.121 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.607 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 5.4 mp0 -49.11 -38.71 25.63 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.389 -1.324 . . . . 0.0 108.16 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.586 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.7 mt-10 -69.76 -41.27 75.39 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.21 -52.69 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 95' ' ' ALA . 72.0 mt -50.95 -56.57 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.557 -0.714 . . . . 0.0 109.139 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -70.22 -37.23 74.99 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.169 -0.957 . . . . 0.0 110.087 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.95 -32.73 34.94 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.0 mt -92.21 -7.07 49.32 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.365 -1.08 . . . . 0.0 109.135 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 68.09 40.97 2.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.746 -0.596 . . . . 0.0 110.122 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.27 140.45 85.21 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.102 -0.999 . . . . 0.0 108.844 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.557 ' C ' ' H ' ' A' ' 90' ' ' SER . 44.3 Cg_endo -70.69 141.57 41.76 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 122.181 1.92 . . . . 0.0 112.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.8 p -55.83 -0.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.399 -0.813 . . . . 0.0 109.845 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.557 ' H ' ' C ' ' A' ' 88' ' ' PRO . 84.4 p -66.51 -26.82 67.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.168 -0.958 . . . . 0.0 109.947 -178.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.422 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.3 mt -98.68 102.93 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.86 -1.15 . . . . 0.0 109.353 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.3 p -74.73 -27.79 60.51 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.044 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.5 m -94.2 37.82 1.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.475 -0.766 . . . . 0.0 109.196 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.69 -65.09 0.74 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.32 -0.862 . . . . 0.0 108.903 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.641 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.62 -51.7 20.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -0.894 . . . . 0.0 109.619 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.479 ' O ' ' OG1' ' A' ' 100' ' ' THR . 5.8 tp -58.73 -43.89 90.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.934 -1.104 . . . . 0.0 109.173 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.746 HG21 ' SD ' ' A' ' 49' ' ' MET . 10.6 m -62.69 -41.22 99.0 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.036 -1.04 . . . . 0.0 108.827 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.49 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -67.61 -43.08 81.31 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.428 -0.795 . . . . 0.0 109.509 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.707 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.7 ttm180 -68.62 -51.45 42.13 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.338 -0.851 . . . . 0.0 111.291 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.2 m -55.17 -52.32 63.69 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.195 -0.941 . . . . 0.0 110.009 -178.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -62.87 -42.09 99.63 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.201 -0.937 . . . . 0.0 111.377 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.6 t80 -58.55 -42.23 87.41 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.453 -1.404 . . . . 0.0 110.074 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.569 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.2 ttm -53.36 -54.79 31.46 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.377 -0.827 . . . . 0.0 111.253 -178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -73.45 -54.71 7.61 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.936 -1.102 . . . . 0.0 113.068 -176.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.413 ' C ' HD12 ' A' ' 106' ' ' LEU . 51.9 m-85 -84.07 -46.39 12.03 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.679 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.1 mp -96.02 -5.9 40.02 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.189 -1.569 . . . . 0.0 113.631 -176.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.641 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 83.2 t80 -59.89 -37.01 44.65 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 119.966 -1.708 . . . . 0.0 110.123 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.637 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 13.4 Cg_exo -69.03 -52.86 0.35 Allowed 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.378 2.052 . . . . 0.0 112.501 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -59.91 -42.52 94.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.408 -0.807 . . . . 0.0 109.587 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -69.42 -51.53 35.52 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.35 -0.844 . . . . 0.0 110.324 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 71.4 m -70.8 -42.36 70.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.348 -0.845 . . . . 0.0 110.49 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -66.81 -51.48 55.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.837 -1.164 . . . . 0.0 111.149 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -74.28 -26.12 60.01 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.035 -1.04 . . . . 0.0 111.408 -178.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.485 ' HG2' HD21 ' A' ' 116' ' ' LEU . 38.5 tptt -125.76 -29.73 3.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.977 -1.077 . . . . 0.0 111.607 -177.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.554 ' N ' ' O ' ' A' ' 111' ' ' CYS . 37.4 t30 55.96 45.82 23.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.685 -1.259 . . . . 0.0 109.885 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.485 HD21 ' HG2' ' A' ' 114' ' ' LYS . 53.3 mt -66.77 -33.14 74.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.267 -0.895 . . . . 0.0 111.174 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.496 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 10.7 t -155.57 -161.09 1.11 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 118.893 -1.123 . . . . 0.0 111.341 -178.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 71.1 p -125.53 164.22 33.85 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.738 -0.601 . . . . 0.0 109.66 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.495 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 16.5 Cg_exo -64.54 -36.14 44.63 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.549 1.499 . . . . 0.0 111.873 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.29 82.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.098 -1.001 . . . . 0.0 109.356 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 48.3 mt-10 -67.33 -45.22 77.06 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.569 HD21 ' HG3' ' A' ' 103' ' ' MET . 14.7 tp -66.2 -50.87 62.38 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.486 -0.759 . . . . 0.0 109.501 178.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -59.05 -46.17 88.9 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.098 -1.001 . . . . 0.0 109.311 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.73 97.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.373 -0.829 . . . . 0.0 110.381 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.69 73.63 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.508 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.1 mt -66.63 -51.16 59.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.08 -39.52 94.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.467 -0.77 . . . . 0.0 109.791 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -30.56 72.16 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.707 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 28.6 p30 -89.57 -24.99 21.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.335 -1.097 . . . . 0.0 110.299 -178.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.645 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.998 -1.064 . . . . 0.0 109.595 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.887 ' O ' HG12 ' A' ' 13' ' ' VAL . 47.8 mt-30 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.152 0.501 . . . . 0.0 109.81 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -48.56 -49.28 37.19 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 109.791 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -61.76 -40.04 93.75 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.418 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -67.42 -53.24 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.368 -0.833 . . . . 0.0 111.549 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.887 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.1 p -69.69 -38.72 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.038 -1.039 . . . . 0.0 110.197 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -60.72 -39.28 88.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.125 -1.61 . . . . 0.0 108.258 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.405 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.1 OUTLIER -58.31 -29.44 65.89 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.229 -0.92 . . . . 0.0 108.68 178.689 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 46' ' ' LEU . 9.6 mt -69.75 -40.22 76.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.44 -0.787 . . . . 0.0 111.464 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.454 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 91.4 m-85 -75.22 -36.83 61.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.402 -1.436 . . . . 0.0 109.864 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.481 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -62.32 -28.13 69.52 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 110.81 -177.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.634 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.3 mt -37.43 -41.42 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 O-C-N 121.602 -0.686 . . . . 0.0 110.738 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.612 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.82 168.18 5.08 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.733 -1.229 . . . . 0.0 110.598 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -90.97 65.5 5.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.614 -0.678 . . . . 0.0 110.526 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.65 137.3 20.21 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.201 -0.937 . . . . 0.0 108.563 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.88 -61.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.078 1.852 . . . . 0.0 112.262 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -34.89 71.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.132 -0.98 . . . . 0.0 109.581 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.634 ' NH2' HD13 ' A' ' 19' ' ' ILE . 59.6 ttt180 -58.48 -42.22 87.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.179 -0.95 . . . . 0.0 110.166 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -60.29 -53.29 59.36 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.86 -1.136 . . . . 0.0 108.482 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.22 -35.55 60.05 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.567 -0.708 . . . . 0.0 109.244 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -64.45 -61.84 1.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.448 -0.783 . . . . 0.0 110.995 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 16' ' ' LEU . 70.7 mt -55.07 -46.96 75.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.915 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.454 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 39.1 m-20 -62.65 -46.64 87.29 Favored 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.492 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -67.17 -43.59 81.86 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.018 -1.051 . . . . 0.0 109.448 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.9 tp -56.32 -50.59 71.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 -179.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -61.78 -34.13 75.32 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.108 -1.437 . . . . 0.0 107.709 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.4 m -69.51 -53.02 21.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 109.553 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.419 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 60.0 t80 -59.14 -44.0 92.05 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.499 -0.751 . . . . 0.0 110.304 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 73.4 mmm -59.03 -37.46 77.03 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.666 -0.646 . . . . 0.0 110.462 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -59.39 -41.53 89.59 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.095 -1.003 . . . . 0.0 109.97 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.62 -46.34 79.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.511 HH11 ' HB2' ' A' ' 108' ' ' PRO . 2.8 mtp180 -62.59 -23.68 67.16 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.336 -0.852 . . . . 0.0 110.719 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.41 2.08 60.45 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 68.2 p -117.24 83.36 15.72 Favored Pre-proline 0 N--CA 1.493 1.693 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -86.98 145.62 7.58 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.987 2.458 . . . . 0.0 111.7 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD23 ' A' ' 46' ' ' LEU . 47.6 mt -79.86 98.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.082 -1.011 . . . . 0.0 109.142 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 19.8 m120 -63.14 -45.14 93.35 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -138.51 134.91 34.53 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.596 HD23 HG21 ' A' ' 43' ' ' ILE . 12.0 mt -70.93 144.62 90.64 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.816 -1.178 . . . . 0.0 109.463 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.78 116.29 4.66 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 121.587 1.524 . . . . 0.0 109.425 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.494 HG23 ' N ' ' A' ' 52' ' ' SER . 52.7 mt -82.59 144.19 10.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.001 -1.062 . . . . 0.0 110.061 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 46.9 mmm -139.59 124.97 19.06 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.7 41.06 3.09 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -177.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.3 mttm 59.16 22.69 10.89 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.342 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.494 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -140.02 157.43 45.68 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.987 -1.071 . . . . 0.0 110.133 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.7 m -66.73 144.3 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 120.964 -1.085 . . . . 0.0 109.019 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.559 HD21 HD22 ' A' ' 59' ' ' LEU . 44.0 tp -78.63 124.07 27.79 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.364 -0.835 . . . . 0.0 109.767 -179.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.515 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.0 m-20 -65.74 90.68 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.441 -0.787 . . . . 0.0 109.246 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 mt -55.44 -23.85 27.53 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.075 -1.016 . . . . 0.0 109.186 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -80.31 -57.94 3.37 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.179 -0.951 . . . . 0.0 111.58 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.7 -38.78 79.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.55 -1.344 . . . . 0.0 108.88 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.559 HD22 HD21 ' A' ' 54' ' ' LEU . 53.7 tp -58.18 -46.2 86.16 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.429 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.5 t80 -59.45 -66.18 0.55 Allowed 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.453 0.644 . . . . 0.0 109.303 178.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -42.04 -40.77 2.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.508 -0.745 . . . . 0.0 110.571 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.1 mt -71.69 -45.73 60.97 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.011 -1.476 . . . . 0.0 107.797 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.809 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.3 t -56.18 -45.07 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.137 -0.977 . . . . 0.0 110.253 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.429 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.7 mm -67.99 -35.98 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.665 -1.272 . . . . 0.0 107.894 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.31 -20.79 45.93 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 21.2 mmt-85 -93.88 0.81 56.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.579 -1.326 . . . . 0.0 108.443 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.39 13.62 73.12 Favored Glycine 0 N--CA 1.492 2.395 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.981 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.42 135.92 3.42 Favored Glycine 0 N--CA 1.502 3.058 0 CA-C-N 119.366 1.583 . . . . 0.0 111.391 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' CH2' ' A' ' 78' ' ' TRP . 11.0 tp -52.42 -39.62 61.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.553 -0.969 . . . . 0.0 110.374 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.506 HG22 ' HA ' ' A' ' 122' ' ' LEU . 85.3 t -58.74 -45.1 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.02 -1.05 . . . . 0.0 109.772 -178.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.33 -39.16 69.65 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.029 -1.045 . . . . 0.0 108.651 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.8 t -63.94 -41.23 91.84 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.506 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.403 HG12 ' NH1' ' A' ' 99' ' ' ARG . 64.0 mt -66.96 -61.86 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 O-C-N 120.82 -1.175 . . . . 0.0 110.384 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -57.73 -40.16 78.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.192 -0.942 . . . . 0.0 110.215 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -91.61 -11.63 36.6 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.172 -0.955 . . . . 0.0 110.685 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.1 mtmt 58.73 60.11 2.64 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -178.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -94.63 14.44 21.03 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.935 -1.103 . . . . 0.0 108.773 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.611 ' CH2' HD11 ' A' ' 69' ' ' LEU . 81.6 m95 -62.97 -39.52 94.95 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.124 -0.985 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 78' ' ' TRP . 95.4 mm-40 -48.85 -39.39 25.46 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.379 -1.451 . . . . 0.0 108.371 178.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 79.0 mm-40 -66.25 -39.93 89.84 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.406 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -73.67 -50.55 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.553 -0.717 . . . . 0.0 109.211 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.781 HD11 ' HB2' ' A' ' 95' ' ' ALA . 79.7 mt -51.8 -54.02 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.509 -0.744 . . . . 0.0 109.5 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.41 -38.9 68.28 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.037 -1.04 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.74 -32.37 40.04 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.3 mt -90.47 -7.05 54.03 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.393 -1.063 . . . . 0.0 109.156 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 65.85 40.44 4.22 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.838 -0.539 . . . . 0.0 110.633 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.73 141.5 82.37 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 108.483 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.553 ' C ' ' H ' ' A' ' 90' ' ' SER . 57.6 Cg_endo -73.32 143.66 35.53 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.055 1.837 . . . . 0.0 112.532 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.7 m -58.06 1.42 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.356 -0.84 . . . . 0.0 109.664 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.553 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.6 p -66.57 -24.56 66.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.186 -0.947 . . . . 0.0 109.966 -178.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.544 HD11 ' H ' ' A' ' 50' ' ' ALA . 81.6 mt -103.06 107.09 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 120.989 -1.069 . . . . 0.0 109.412 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.3 p -76.48 -28.15 56.36 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 108.729 179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 m -90.26 30.95 1.04 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.531 -0.731 . . . . 0.0 109.36 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.24 -64.74 0.85 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.781 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.57 -52.73 36.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 0.0 109.409 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.96 -44.71 91.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.825 -1.172 . . . . 0.0 108.884 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.1 m -59.06 -40.87 86.46 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 59' ' ' LEU . 13.9 mt -68.75 -42.23 77.83 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.616 -0.678 . . . . 0.0 109.266 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.465 ' HG3' HH11 ' A' ' 99' ' ' ARG . 11.1 ttm-85 -65.05 -52.37 56.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.123 -0.986 . . . . 0.0 110.415 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.5 m -57.32 -53.65 55.67 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.429 -0.794 . . . . 0.0 110.341 -178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -64.79 -44.53 89.67 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.831 -1.168 . . . . 0.0 112.178 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.7 t80 -57.91 -40.12 79.62 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.087 -1.633 . . . . 0.0 108.783 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 1.013 ' SD ' HD21 ' A' ' 122' ' ' LEU . 55.8 mmm -52.55 -58.86 5.43 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.67 -0.644 . . . . 0.0 111.909 -179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -73.76 -50.8 18.89 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.559 -1.338 . . . . 0.0 112.818 -176.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.468 ' C ' HD12 ' A' ' 106' ' ' LEU . 63.8 m-85 -83.97 -48.53 9.86 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.9 mp -99.39 6.04 46.18 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.255 -1.528 . . . . 0.0 113.819 -176.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.528 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 36.0 t80 -66.58 -38.84 21.27 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.042 -1.661 . . . . 0.0 111.09 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.2 Cg_endo -78.64 -41.55 0.25 Allowed 'Trans proline' 0 N--CA 1.487 1.145 0 C-N-CA 121.472 1.448 . . . . 0.0 112.568 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.78 -42.62 89.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.85 -1.156 . . . . 0.0 108.348 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.96 -43.56 62.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.436 -0.79 . . . . 0.0 110.035 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.586 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.8 t -79.95 -46.27 17.01 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.1 -1.0 . . . . 0.0 110.927 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.8 tp10 -66.34 -45.62 79.6 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.737 -1.227 . . . . 0.0 110.634 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -75.34 -35.37 61.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.115 -0.99 . . . . 0.0 110.965 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.1 tptp -118.39 -27.15 6.06 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.012 -1.055 . . . . 0.0 111.876 -177.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 111' ' ' CYS . 36.6 t-20 55.08 45.48 26.11 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.748 -1.22 . . . . 0.0 110.474 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.2 mt -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.105 -0.997 . . . . 0.0 110.561 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.477 ' OG ' ' N ' ' A' ' 118' ' ' THR . 37.8 t -153.02 -167.03 2.61 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.153 -1.019 . . . . 0.0 111.056 -178.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.477 ' N ' ' OG ' ' A' ' 117' ' ' SER . 65.5 p -127.32 159.12 67.02 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.574 -0.704 . . . . 0.0 110.171 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -55.97 -41.94 71.89 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.691 1.594 . . . . 0.0 112.665 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.6 91.81 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.878 -1.139 . . . . 0.0 109.754 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.55 -44.37 82.51 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.013 HD21 ' SD ' ' A' ' 103' ' ' MET . 15.2 tp -66.55 -52.41 45.93 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.664 -0.648 . . . . 0.0 110.251 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -57.64 -46.18 84.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.055 -1.028 . . . . 0.0 109.554 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.78 87.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.85 -34.55 76.92 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.285 -0.885 . . . . 0.0 108.75 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.599 ' CD1' ' HE1' ' A' ' 103' ' ' MET . 10.4 mt -66.25 -49.09 78.59 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -61.68 -38.24 87.07 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.069 -1.019 . . . . 0.0 108.709 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.59 -28.71 73.57 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.9 p-10 -89.92 -30.19 18.02 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.694 -1.474 . . . . 0.0 110.335 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.655 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 O-C-N 120.886 -1.134 . . . . 0.0 109.123 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 33.3 mm-40 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 121.268 0.556 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.01 -49.76 65.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.975 -1.078 . . . . 0.0 109.649 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -62.19 -42.14 99.0 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.172 -0.955 . . . . 0.0 109.336 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.41 ' C ' HD11 ' A' ' 46' ' ' LEU . 18.0 mm100 -65.27 -49.76 68.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.58 -0.7 . . . . 0.0 110.805 -179.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.41 HG13 ' O ' ' A' ' 9' ' ' GLN . 4.1 m -71.74 -35.99 57.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 120.692 -1.255 . . . . 0.0 108.641 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.494 ' O ' ' OE1' ' A' ' 18' ' ' GLU . 6.9 tpt180 -54.56 -40.81 69.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.614 -1.304 . . . . 0.0 107.532 178.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -58.49 -31.4 67.81 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.452 ' HA ' HD12 ' A' ' 19' ' ' ILE . 10.2 mt -72.63 -37.34 68.06 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.433 -0.792 . . . . 0.0 111.469 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -77.49 -33.13 54.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.364 -1.46 . . . . 0.0 110.009 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.503 ' O ' ' C ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -69.48 -27.86 65.58 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.088 -1.007 . . . . 0.0 111.282 -177.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.503 ' C ' ' O ' ' A' ' 18' ' ' GLU . 19.3 mt -35.74 -38.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.672 -0.642 . . . . 0.0 110.161 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.515 ' ND2' ' N ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -173.56 168.24 4.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.071 -1.018 . . . . 0.0 110.153 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -90.86 74.43 6.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.656 -0.653 . . . . 0.0 110.044 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -108.82 134.36 20.36 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.7 -59.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 122.079 1.853 . . . . 0.0 112.305 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -58.66 -34.18 70.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.616 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.692 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -57.09 -42.12 80.16 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.016 -1.052 . . . . 0.0 109.384 -179.613 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -61.4 -54.27 45.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.903 -1.123 . . . . 0.0 108.707 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -52.97 -37.24 61.02 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -62.47 -62.57 1.66 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.48 -0.763 . . . . 0.0 109.854 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.514 HD21 HH12 ' A' ' 25' ' ' ARG . 82.0 mt -54.8 -46.34 74.47 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 121.528 0.68 . . . . 0.0 109.72 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.4 -49.65 76.01 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.003 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -66.54 -43.62 84.64 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.179 -0.95 . . . . 0.0 110.197 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.33 -52.12 64.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.967 . . . . 0.0 110.416 -178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.448 ' CE1' HD12 ' A' ' 43' ' ' ILE . 43.9 m-85 -62.48 -32.63 73.56 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.771 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 t -67.51 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 111.311 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.597 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -63.6 -27.32 69.16 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 111.232 -178.422 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.0 mmm -64.13 -39.55 94.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.934 -1.104 . . . . 0.0 111.057 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.09 -36.39 81.56 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.939 -1.101 . . . . 0.0 110.524 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -59.4 -50.09 75.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.211 -0.931 . . . . 0.0 111.065 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB3' ' A' ' 108' ' ' PRO . 28.5 mtp180 -64.19 -19.78 65.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.807 -178.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.91 3.47 55.91 Favored Glycine 0 N--CA 1.482 1.718 0 N-CA-C 108.187 -1.965 . . . . 0.0 108.187 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.1 p -117.42 83.99 17.58 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.587 -0.949 . . . . 0.0 108.943 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.66 150.36 2.3 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 123.441 2.76 . . . . 0.0 111.755 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.533 HG21 HD23 ' A' ' 46' ' ' LEU . 55.7 mt -84.87 98.19 5.96 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 120.865 -1.147 . . . . 0.0 109.153 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 25.0 m120 -79.65 -12.95 59.8 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.466 ' CG ' ' O ' ' A' ' 45' ' ' ARG . 0.5 OUTLIER -159.4 122.93 3.72 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 43' ' ' ILE . 3.6 mt -71.46 147.1 92.41 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 120.728 -1.232 . . . . 0.0 109.349 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.82 138.14 40.15 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 121.279 1.319 . . . . 0.0 108.967 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 52' ' ' SER . 6.6 mt -105.64 146.08 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 120.9 -1.125 . . . . 0.0 110.17 -178.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.669 ' SD ' HD13 ' A' ' 54' ' ' LEU . 77.9 mtp -143.26 122.37 12.9 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.47 39.8 1.54 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 72.6 mttt 58.15 24.49 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.478 0.656 . . . . 0.0 109.654 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' HG23 ' A' ' 48' ' ' ILE . 85.8 p -138.31 157.3 46.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.533 -0.729 . . . . 0.0 109.153 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -69.54 149.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.965 -1.084 . . . . 0.0 109.472 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.68 HD21 HD22 ' A' ' 59' ' ' LEU . 59.1 tp -82.12 124.24 29.68 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.378 -0.826 . . . . 0.0 109.741 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.41 92.94 0.07 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.592 -0.693 . . . . 0.0 110.065 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -54.34 -26.21 28.57 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 120.821 -1.174 . . . . 0.0 109.318 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -78.4 -62.6 1.63 Allowed 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.951 . . . . 0.0 111.584 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.68 -36.65 67.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.685 -1.259 . . . . 0.0 109.458 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.68 HD22 HD21 ' A' ' 54' ' ' LEU . 54.6 tp -61.07 -45.63 93.97 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 178.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.456 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.8 t80 -61.83 -68.13 0.35 Allowed 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.296 0.569 . . . . 0.0 109.506 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.431 ' C ' ' O ' ' A' ' 60' ' ' TYR . 57.3 t30 -42.57 -36.98 1.52 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.405 -0.809 . . . . 0.0 109.567 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.625 HD13 ' HA ' ' A' ' 81' ' ' ILE . 8.0 mt -70.42 -50.86 34.14 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.031 -1.043 . . . . 0.0 108.448 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.866 HG21 ' CE2' ' A' ' 102' ' ' TYR . 42.3 t -58.05 -42.59 83.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.097 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.456 HG13 ' CE2' ' A' ' 60' ' ' TYR . 11.2 mm -70.14 -34.82 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.572 -1.33 . . . . 0.0 108.151 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.445 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.33 -24.1 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.735 -0.603 . . . . 0.0 110.724 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.515 ' CG ' HD13 ' A' ' 77' ' ' LEU . 8.0 mpt_? -94.14 3.72 54.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.622 -1.298 . . . . 0.0 109.564 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 16.21 69.99 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.251 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.92 134.89 3.38 Favored Glycine 0 N--CA 1.501 2.995 0 O-C-N 120.502 -1.587 . . . . 0.0 111.424 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.636 HD11 ' CH2' ' A' ' 78' ' ' TRP . 16.1 tp -52.74 -40.18 62.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.644 -0.916 . . . . 0.0 110.863 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.565 HG11 ' HB3' ' A' ' 121' ' ' GLU . 58.6 t -57.05 -42.98 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.893 -1.129 . . . . 0.0 109.318 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -57.56 -40.39 78.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.918 -1.113 . . . . 0.0 109.538 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 78.8 t -64.69 -43.19 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.376 -0.828 . . . . 0.0 110.271 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.426 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 61.1 mt -66.33 -55.4 18.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 O-C-N 120.878 -1.139 . . . . 0.0 110.273 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.5 m-20 -57.63 -42.39 83.3 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.159 -0.963 . . . . 0.0 110.266 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -93.58 -9.4 38.27 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.196 -0.94 . . . . 0.0 110.643 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 27.2 mtmm 58.56 60.17 2.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.409 -0.807 . . . . 0.0 109.849 -178.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 14.94 12.34 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.636 ' CH2' HD11 ' A' ' 69' ' ' LEU . 99.0 m95 -61.27 -40.86 95.68 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.5 mt-30 -47.22 -39.9 15.1 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.748 -1.22 . . . . 0.0 108.673 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' ' NH2' ' A' ' 66' ' ' ARG . 76.5 mm-40 -68.54 -41.68 79.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.625 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.2 mt -69.5 -52.85 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 95' ' ' ALA . 50.5 mt -53.98 -55.34 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.607 -0.683 . . . . 0.0 109.448 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 86' ' ' HIS . 68.5 mttt -68.4 -42.27 79.27 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.336 -0.853 . . . . 0.0 109.869 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.16 -31.36 26.29 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.3 mt -91.15 -7.45 51.46 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.463 -1.022 . . . . 0.0 109.037 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 83' ' ' LYS . 71.3 m-70 62.8 42.32 8.06 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.837 -0.539 . . . . 0.0 110.124 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.7 mt -71.95 137.61 82.28 Favored Pre-proline 0 N--CA 1.488 1.453 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.586 ' C ' ' H ' ' A' ' 90' ' ' SER . 31.6 Cg_endo -66.9 141.57 59.23 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.892 1.728 . . . . 0.0 112.264 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 32.5 m -55.82 1.26 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.201 -0.937 . . . . 0.0 109.995 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.586 ' H ' ' C ' ' A' ' 88' ' ' PRO . 85.4 p -65.89 -25.35 67.13 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.099 -1.001 . . . . 0.0 109.805 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.549 HD11 ' H ' ' A' ' 50' ' ' ALA . 74.1 mt -100.47 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.064 -1.023 . . . . 0.0 109.205 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.4 p -76.98 -23.32 52.3 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.178 -0.951 . . . . 0.0 109.164 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.1 m -100.25 39.27 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.448 -0.783 . . . . 0.0 109.067 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.55 -63.75 1.05 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.87 . . . . 0.0 109.294 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.55 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.23 -51.53 14.19 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.21 -0.932 . . . . 0.0 109.612 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -59.01 -43.32 91.53 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.774 -1.204 . . . . 0.0 108.895 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 63.6 m -60.92 -41.24 95.77 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.992 -1.067 . . . . 0.0 108.531 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 95' ' ' ALA . 10.4 mt -70.19 -44.11 69.37 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.498 -0.751 . . . . 0.0 109.841 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.569 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.3 ttm-85 -67.0 -53.37 32.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.292 -0.88 . . . . 0.0 110.925 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 m -55.0 -50.06 69.95 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.029 -1.044 . . . . 0.0 109.335 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -64.2 -43.87 93.72 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.145 -0.972 . . . . 0.0 111.624 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.866 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.35 -41.42 84.64 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.422 -1.424 . . . . 0.0 109.183 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.761 ' HG2' HD21 ' A' ' 122' ' ' LEU . 81.5 mtp -50.91 -56.48 12.1 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.584 -0.697 . . . . 0.0 111.431 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.0 mttt -73.58 -55.92 5.69 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.933 -1.104 . . . . 0.0 113.15 -176.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' LEU . 56.2 m-85 -84.24 -46.4 11.87 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 115.4 1.629 . . . . 0.0 115.4 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 106' ' ' LEU . 5.8 mp -97.6 -4.87 36.75 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.212 -1.555 . . . . 0.0 113.177 -176.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 39.2 t80 -62.81 -36.65 27.3 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 120.074 -1.641 . . . . 0.0 109.466 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.6 Cg_exo -66.17 -52.74 0.79 Allowed 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 122.15 1.9 . . . . 0.0 111.678 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.29 -48.46 80.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.292 -0.88 . . . . 0.0 109.504 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.49 -47.77 69.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.118 -0.989 . . . . 0.0 110.368 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.6 t -73.99 -46.36 44.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.984 -1.073 . . . . 0.0 110.719 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.597 ' OE1' ' CZ ' ' A' ' 35' ' ' PHE . 35.2 tt0 -66.88 -51.89 50.0 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 120.904 -1.122 . . . . 0.0 111.304 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -74.57 -32.39 62.38 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.119 -0.988 . . . . 0.0 111.874 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.41 ' HG2' HD21 ' A' ' 116' ' ' LEU . 35.4 tptt -117.25 -29.69 5.82 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.895 -1.128 . . . . 0.0 111.616 -177.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 111' ' ' CYS . 19.0 t-20 54.83 44.78 27.88 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.683 -1.261 . . . . 0.0 110.481 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.41 HD21 ' HG2' ' A' ' 114' ' ' LYS . 74.7 mt -67.36 -28.33 67.86 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.992 -1.068 . . . . 0.0 110.903 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 118' ' ' THR . 4.5 t -153.61 -168.17 2.91 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.273 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.597 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.1 p -122.8 152.5 62.51 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.53 -178.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.415 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 9.5 Cg_endo -55.02 -36.76 93.45 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 C-N-CA 122.042 1.828 . . . . 0.0 112.08 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.33 83.24 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.943 -1.098 . . . . 0.0 109.243 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.565 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.7 mt-10 -65.93 -44.49 84.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 177.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 103' ' ' MET . 33.0 tp -63.56 -51.79 63.85 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.727 -0.608 . . . . 0.0 109.445 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -58.01 -50.13 74.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.241 -0.912 . . . . 0.0 109.658 178.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.24 -41.4 96.83 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.41 -0.806 . . . . 0.0 110.209 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.469 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.22 -33.57 74.66 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 103' ' ' MET . 5.5 mt -63.46 -49.78 81.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.97 -36.96 82.99 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.23 -32.98 78.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.2 OUTLIER -92.59 -29.47 16.13 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.016 -1.285 . . . . 0.0 110.366 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.631 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.088 -1.007 . . . . 0.0 109.855 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.866 ' O ' HG12 ' A' ' 13' ' ' VAL . 35.4 mt-30 . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.83 -47.66 51.36 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.334 -0.854 . . . . 0.0 109.052 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -62.29 -41.56 98.6 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.156 -0.965 . . . . 0.0 109.6 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -65.78 -51.14 61.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.948 . . . . 0.0 110.47 -179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.866 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.3 p -70.92 -37.05 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 120.989 -1.07 . . . . 0.0 109.845 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.608 HH11 ' CG ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -61.39 -38.37 86.82 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 119.926 -1.734 . . . . 0.0 108.03 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -30.23 66.24 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.466 HD11 HD22 ' A' ' 46' ' ' LEU . 13.4 mt -69.37 -39.55 77.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.459 -0.775 . . . . 0.0 111.358 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.461 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -76.15 -35.44 59.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.375 -1.453 . . . . 0.0 110.158 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.3 mt-10 -62.21 -27.74 69.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.036 -1.04 . . . . 0.0 110.019 -177.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 29.9 mt -39.72 -41.01 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 121.7 -0.625 . . . . 0.0 110.346 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.8 m120 -170.32 157.87 6.38 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.07 -1.019 . . . . 0.0 109.341 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 58.4 p30 -94.15 63.25 3.11 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.3 144.28 27.8 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.165 -0.959 . . . . 0.0 108.942 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.25 -60.57 0.06 OUTLIER 'Trans proline' 0 C--N 1.312 -1.356 0 C-N-CA 122.164 1.909 . . . . 0.0 111.771 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' N ' ' HD2' ' A' ' 24' ' ' LYS . 4.7 mptp? -61.33 -36.1 79.23 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.307 -0.87 . . . . 0.0 109.493 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.597 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.3 ttt-85 -57.99 -45.98 85.92 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.978 -1.076 . . . . 0.0 109.192 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -61.46 -56.82 15.93 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.223 -0.923 . . . . 0.0 109.458 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -51.75 -35.25 42.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.498 -0.751 . . . . 0.0 109.585 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -63.17 -62.3 1.79 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 110.655 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.53 HD11 ' NH1' ' A' ' 25' ' ' ARG . 62.8 mt -53.23 -46.82 69.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.882 . . . . 0.0 109.322 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.461 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.1 m-20 -61.27 -46.91 88.4 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.086 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.403 -0.81 . . . . 0.0 110.067 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.621 HD23 HD13 ' A' ' 56' ' ' LEU . 63.5 tp -59.04 -50.06 75.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.028 -1.045 . . . . 0.0 110.733 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -63.06 -35.51 80.5 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.357 -1.337 . . . . 0.0 107.796 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 t -68.25 -52.52 32.99 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.522 -0.736 . . . . 0.0 109.702 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.61 -42.52 88.38 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.506 -0.746 . . . . 0.0 110.378 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.516 ' CE ' ' O ' ' A' ' 41' ' ' THR . 61.6 mmm -60.13 -38.59 83.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.478 -0.764 . . . . 0.0 111.027 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -57.7 -37.06 72.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.658 -1.276 . . . . 0.0 108.833 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -67.36 -47.88 69.12 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.338 -0.851 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 39' ' ' ARG . 2.6 mmm-85 -63.63 -22.59 66.98 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.21 -0.931 . . . . 0.0 110.798 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.24 2.81 61.94 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.516 ' O ' ' CE ' ' A' ' 36' ' ' MET . 60.0 p -116.4 83.64 13.49 Favored Pre-proline 0 N--CA 1.491 1.6 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -85.32 143.81 8.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.877 2.385 . . . . 0.0 111.196 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.7 mt -82.87 103.45 10.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 O-C-N 120.841 -1.162 . . . . 0.0 109.818 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.48 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 90.7 m-20 -67.37 -55.82 12.2 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.583 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.1 OUTLIER -127.31 133.64 50.09 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.177 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.466 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.91 146.35 92.97 Favored Pre-proline 0 C--N 1.3 -1.571 0 O-C-N 121.074 -1.016 . . . . 0.0 109.59 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -70.27 132.17 21.97 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.536 1.491 . . . . 0.0 108.967 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mt -99.55 141.4 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 120.771 -1.206 . . . . 0.0 109.917 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.3 mtp -140.78 121.19 14.03 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 72.05 39.76 0.78 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.6 mttm 59.41 20.57 8.9 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.257 0.551 . . . . 0.0 110.161 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -139.74 159.35 42.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.093 -1.005 . . . . 0.0 109.395 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.15 146.35 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.985 -1.072 . . . . 0.0 109.414 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.7 HD21 HD22 ' A' ' 59' ' ' LEU . 57.7 tp -78.29 124.8 28.5 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.197 -0.94 . . . . 0.0 108.936 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.17 98.41 0.14 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.692 -0.63 . . . . 0.0 110.449 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.621 HD13 HD23 ' A' ' 32' ' ' LEU . 55.8 mt -56.16 -28.0 56.41 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.97 -1.081 . . . . 0.0 108.566 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -77.68 -60.77 2.23 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.178 -0.951 . . . . 0.0 111.825 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.7 -37.87 74.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.778 -1.201 . . . . 0.0 109.257 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.7 HD22 HD21 ' A' ' 54' ' ' LEU . 52.1 tp -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CE2' HG13 ' A' ' 64' ' ' ILE . 48.8 t80 -62.13 -66.91 0.47 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.674 -0.641 . . . . 0.0 110.072 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 60' ' ' TYR . 58.1 t30 -40.02 -40.86 1.12 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.537 -0.727 . . . . 0.0 111.21 -178.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 mt -73.97 -46.67 42.48 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.031 -1.467 . . . . 0.0 108.023 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.777 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.3 t -53.97 -44.15 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.001 -1.062 . . . . 0.0 109.833 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.401 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.3 mm -68.22 -36.47 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.685 -1.259 . . . . 0.0 107.794 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.82 -15.64 22.28 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.669 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.688 HH21 ' CB ' ' A' ' 80' ' ' GLU . 18.1 mmt-85 -98.27 1.71 47.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.346 -1.471 . . . . 0.0 108.554 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.31 13.01 74.77 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.42 -0.895 . . . . 0.0 111.572 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.87 137.29 3.73 Favored Glycine 0 N--CA 1.504 3.193 0 O-C-N 120.532 -1.569 . . . . 0.0 111.901 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.531 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.6 tp -51.85 -41.72 62.04 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.756 -0.85 . . . . 0.0 110.29 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 122' ' ' LEU . 93.2 t -57.78 -43.72 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.009 -1.057 . . . . 0.0 109.413 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -57.07 -40.48 76.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.067 -1.021 . . . . 0.0 109.238 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 50.8 t -61.83 -43.41 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.45 -0.781 . . . . 0.0 109.916 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -58.55 6.34 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 O-C-N 120.711 -1.243 . . . . 0.0 110.394 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -57.74 -41.05 81.08 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.147 -0.971 . . . . 0.0 110.667 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -93.46 -9.81 37.2 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 19.2 mtmt 59.07 59.36 2.79 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.289 -0.882 . . . . 0.0 109.643 -178.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.2 mt -93.95 15.58 16.49 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.89 -1.131 . . . . 0.0 108.592 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.531 ' HH2' HD11 ' A' ' 69' ' ' LEU . 86.9 m95 -63.02 -41.68 99.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.358 -0.838 . . . . 0.0 108.924 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.0 mt-30 -48.86 -39.11 24.45 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.519 -1.363 . . . . 0.0 108.442 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.688 ' CB ' HH21 ' A' ' 66' ' ' ARG . 73.7 mm-40 -66.32 -38.65 88.19 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.1 mt -75.26 -52.2 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 0.0 109.09 178.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.0 mt -51.25 -53.77 13.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.323 -0.861 . . . . 0.0 109.03 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -69.75 -38.71 76.9 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.27 -0.894 . . . . 0.0 109.334 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.43 -34.36 48.69 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 88.7 mt -86.68 -8.71 57.19 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.445 -1.033 . . . . 0.0 108.587 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 64.29 40.36 6.67 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.758 -0.589 . . . . 0.0 109.901 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -74.61 143.67 79.3 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 108.996 178.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 50' ' ' ALA . 37.4 Cg_endo -70.2 143.3 48.3 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.982 1.788 . . . . 0.0 111.597 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p -60.23 1.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.892 . . . . 0.0 110.162 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 88' ' ' PRO . 91.4 p -66.43 -22.2 66.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.162 -0.962 . . . . 0.0 110.062 -178.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.547 HD11 ' H ' ' A' ' 50' ' ' ALA . 65.4 mt -100.11 106.18 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.927 -1.108 . . . . 0.0 109.346 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.7 p -78.56 -25.33 45.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -0.949 . . . . 0.0 108.714 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -93.88 32.36 1.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' O ' ' C ' ' A' ' 95' ' ' ALA . . . -63.77 -65.5 0.67 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.32 -0.863 . . . . 0.0 109.096 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.33 -52.14 17.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.99 -1.069 . . . . 0.0 108.99 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.454 ' O ' ' OG1' ' A' ' 100' ' ' THR . 8.4 tp -58.03 -44.76 87.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.097 -1.002 . . . . 0.0 109.191 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.3 m -61.78 -39.67 92.5 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.089 -1.007 . . . . 0.0 108.758 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 95' ' ' ALA . 11.2 mt -67.44 -45.16 76.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.511 -0.743 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -68.93 -49.24 59.81 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.139 -0.976 . . . . 0.0 111.219 -179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -55.01 -54.42 43.2 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 120.913 -1.117 . . . . 0.0 109.565 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -63.42 -42.38 98.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.097 -1.002 . . . . 0.0 111.777 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.777 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.13 -42.73 81.47 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.162 -1.586 . . . . 0.0 109.142 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.758 ' SD ' HD11 ' A' ' 126' ' ' ILE . 84.7 mtp -54.41 -56.21 20.94 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.623 -0.673 . . . . 0.0 112.337 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -71.4 -48.89 46.97 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.28 -1.512 . . . . 0.0 112.392 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.516 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -86.29 -52.35 5.69 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -174.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.751 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.0 mp -98.0 12.15 35.2 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.287 -1.508 . . . . 0.0 113.74 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.569 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 55.2 t80 -66.89 -37.15 13.15 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 119.93 -1.731 . . . . 0.0 111.638 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.7 Cg_endo -82.47 -38.75 0.17 Allowed 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.705 1.604 . . . . 0.0 112.532 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.7 -41.39 86.19 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -72.02 -49.34 37.69 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.569 -0.707 . . . . 0.0 109.926 179.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.8 OUTLIER -73.82 -45.48 51.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.324 -0.86 . . . . 0.0 110.891 -178.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.43 -47.77 72.15 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.057 -1.027 . . . . 0.0 110.905 -178.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 22.0 mmtp -77.02 -27.33 54.54 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 120.978 -1.076 . . . . 0.0 111.333 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.483 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.8 tptp -125.3 -29.27 3.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.9 -1.125 . . . . 0.0 111.536 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 111' ' ' CYS . 61.6 t30 59.45 45.13 14.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.59 -1.319 . . . . 0.0 109.987 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.483 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.5 mt -67.82 -33.63 75.16 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.301 -0.875 . . . . 0.0 111.211 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 118' ' ' THR . 28.8 t -154.28 -166.98 2.49 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.627 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.547 ' N ' ' OG ' ' A' ' 117' ' ' SER . 77.9 p -128.45 163.36 45.08 Favored Pre-proline 0 N--CA 1.498 1.934 0 O-C-N 121.795 -0.566 . . . . 0.0 109.86 -178.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.413 ' CD ' ' OH ' ' A' ' 107' ' ' TYR . 35.9 Cg_exo -59.7 -40.31 65.71 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 121.763 1.642 . . . . 0.0 112.404 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.08 -37.94 89.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.825 -1.172 . . . . 0.0 109.665 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.406 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -67.0 -44.92 79.13 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.692 HD21 ' HG2' ' A' ' 103' ' ' MET . 19.1 tp -66.51 -53.19 37.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.597 -0.69 . . . . 0.0 110.275 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -56.18 -46.55 79.34 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 108.982 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.79 -39.31 88.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.468 -0.77 . . . . 0.0 109.77 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.51 76.48 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.233 -0.917 . . . . 0.0 108.664 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.758 HD11 ' SD ' ' A' ' 103' ' ' MET . 16.9 mt -65.01 -49.48 79.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.89 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -62.08 -37.94 86.93 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.44 -32.72 85.15 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.622 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.1 OUTLIER -93.94 -33.51 13.44 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.805 -1.409 . . . . 0.0 110.592 -179.017 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.617 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 54.6 mtp180 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 120.748 -1.22 . . . . 0.0 109.616 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.708 ' O ' HG13 ' A' ' 13' ' ' VAL . 45.9 mm-40 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.176 0.512 . . . . 0.0 109.879 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CE1' ' NE ' ' A' ' 14' ' ' ARG . 84.6 t80 -58.75 -52.54 65.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.213 -0.93 . . . . 0.0 109.733 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -61.5 -47.11 87.11 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.272 -0.893 . . . . 0.0 109.889 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.438 ' O ' HD11 ' A' ' 46' ' ' LEU . 90.4 mt-30 -63.85 -50.42 68.93 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.418 -0.801 . . . . 0.0 110.896 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.708 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.4 m -69.48 -34.61 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 120.61 -1.306 . . . . 0.0 108.595 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.64 ' NE ' ' CE1' ' A' ' 10' ' ' PHE . 13.1 mmt180 -62.68 -39.95 95.56 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.512 -1.367 . . . . 0.0 107.787 178.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.71 -26.02 55.83 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.496 ' CD1' HD13 ' A' ' 46' ' ' LEU . 7.7 mt -78.66 -37.59 41.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.536 -0.727 . . . . 0.0 111.835 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.42 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -79.35 -31.08 42.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.389 -1.445 . . . . 0.0 110.468 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -63.61 -29.81 71.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.882 -1.136 . . . . 0.0 109.639 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.513 HD13 HH22 ' A' ' 25' ' ' ARG . 56.9 mt -43.07 -45.47 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 O-C-N 121.571 -0.705 . . . . 0.0 110.248 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.821 HD21 HH11 ' A' ' 25' ' ' ARG . 0.0 OUTLIER 179.98 125.46 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.238 -0.914 . . . . 0.0 108.618 178.029 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -82.21 78.1 8.93 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 111.416 -177.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -98.01 124.23 48.36 Favored Pre-proline 0 N--CA 1.489 1.487 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -36.39 -57.52 0.58 Allowed 'Trans proline' 0 C--N 1.313 -1.295 0 C-N-CA 122.208 1.938 . . . . 0.0 113.22 -178.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -62.78 -42.07 99.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.047 -1.033 . . . . 0.0 110.76 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.821 HH11 HD21 ' A' ' 20' ' ' ASN . 60.7 ttt180 -60.67 -45.13 95.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.809 -1.182 . . . . 0.0 111.678 -178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -59.89 -51.18 70.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.37 -1.456 . . . . 0.0 108.701 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -54.68 -36.46 64.67 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -59.11 -66.04 0.57 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.277 -0.889 . . . . 0.0 110.221 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.8 mt -55.95 -43.0 77.04 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.495 0.664 . . . . 0.0 109.535 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -60.36 -50.25 74.34 Favored 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.305 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -66.98 -43.56 82.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.227 -0.921 . . . . 0.0 109.838 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.456 ' O ' ' CG ' ' A' ' 36' ' ' MET . 46.9 tp -54.69 -54.07 46.62 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.336 -0.853 . . . . 0.0 110.198 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.34 -33.64 75.97 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.594 -1.316 . . . . 0.0 108.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.6 t -69.81 -63.19 1.12 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.618 -0.676 . . . . 0.0 111.271 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.467 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -62.01 -32.09 72.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.111 -0.993 . . . . 0.0 110.723 -178.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.456 ' CG ' ' O ' ' A' ' 32' ' ' LEU . 62.2 mmm -59.43 -34.92 73.1 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.985 -1.072 . . . . 0.0 109.866 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.59 -40.15 93.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.242 -0.911 . . . . 0.0 110.321 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -58.43 -48.08 81.87 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.474 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.3 OUTLIER -63.71 -21.93 66.65 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.385 -0.822 . . . . 0.0 110.559 -178.35 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.62 7.43 60.26 Favored Glycine 0 N--CA 1.481 1.643 0 N-CA-C 107.837 -2.105 . . . . 0.0 107.837 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 p -117.89 85.2 22.33 Favored Pre-proline 0 N--CA 1.492 1.641 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -93.73 146.72 2.13 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 123.346 2.697 . . . . 0.0 112.154 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.2 mt -79.22 95.59 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 109.535 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.601 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 19.6 m120 -59.37 -28.58 67.0 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -160.64 138.22 9.44 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.496 HD13 ' CD1' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -71.69 145.2 89.43 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 120.976 -1.078 . . . . 0.0 108.544 -179.365 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -66.77 131.34 25.51 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.235 1.29 . . . . 0.0 109.215 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.9 mt -97.39 143.31 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 120.903 -1.123 . . . . 0.0 110.126 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.687 ' SD ' HD13 ' A' ' 54' ' ' LEU . 75.1 mtp -138.98 121.92 16.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 67.78 40.56 2.4 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.1 mttm 57.17 24.24 9.54 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.47 0.652 . . . . 0.0 109.459 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.2 m -135.43 153.42 51.79 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.38 -0.825 . . . . 0.0 109.144 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -70.44 146.64 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.055 -1.028 . . . . 0.0 109.328 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.687 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.4 tp -79.14 123.8 27.72 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.402 -0.811 . . . . 0.0 110.445 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -65.49 88.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 56' ' ' LEU . 19.3 mt -54.42 -24.1 18.56 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 120.995 -1.066 . . . . 0.0 109.552 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.502 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 41.7 t80 -82.29 -56.6 3.81 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 111.735 -178.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.54 -38.49 81.16 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.531 -1.356 . . . . 0.0 109.321 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.467 HD22 HD21 ' A' ' 54' ' ' LEU . 53.6 tp -57.46 -46.49 83.59 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.436 ' CE2' HG13 ' A' ' 64' ' ' ILE . 46.3 t80 -56.98 -64.58 0.83 Allowed 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.624 ' N ' HD22 ' A' ' 61' ' ' ASN . 1.4 m120 -44.3 -40.16 5.06 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.389 -0.819 . . . . 0.0 111.128 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 66' ' ' ARG . 6.9 mt -72.07 -44.34 63.46 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 118.085 -1.446 . . . . 0.0 107.518 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.744 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -60.09 -44.49 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 60' ' ' TYR . 12.3 mm -67.91 -36.5 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.467 -1.396 . . . . 0.0 107.981 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.452 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.4 -20.84 21.39 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.174 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.608 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -93.41 1.5 56.85 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.596 -1.315 . . . . 0.0 109.304 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.89 15.29 75.56 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.014 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.73 2.97 Favored Glycine 0 N--CA 1.498 2.816 0 O-C-N 120.463 -1.61 . . . . 0.0 111.309 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.6 tp -48.45 -38.13 19.05 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.71 -0.876 . . . . 0.0 110.785 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.454 HG22 ' HA ' ' A' ' 122' ' ' LEU . 97.0 t -57.95 -41.74 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 120.846 -1.159 . . . . 0.0 110.476 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -58.78 -37.6 76.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.97 . . . . 0.0 109.914 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' LYS . 21.2 t -66.13 -42.5 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 110.643 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.408 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 48.3 mt -69.48 -57.92 7.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 120.828 -1.17 . . . . 0.0 110.548 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.406 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 92.8 m-20 -58.01 -41.53 83.33 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.047 -1.033 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -92.4 -7.98 46.15 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.261 -0.899 . . . . 0.0 110.428 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.7 mttp 58.12 55.69 5.03 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.309 -0.87 . . . . 0.0 110.592 -179.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 11.1 mt -90.61 12.45 18.86 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.699 -1.25 . . . . 0.0 107.835 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.562 ' CH2' HD11 ' A' ' 69' ' ' LEU . 98.3 m95 -62.31 -41.34 98.46 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mm100 -48.86 -37.71 20.33 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.737 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.608 ' CB ' HH21 ' A' ' 66' ' ' ARG . 93.3 mt-10 -69.62 -40.82 76.35 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -67.49 -53.51 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.489 HD11 ' HB2' ' A' ' 95' ' ' ALA . 62.6 mt -51.27 -57.65 2.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.299 -0.876 . . . . 0.0 109.266 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -66.83 -37.4 84.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.153 -0.967 . . . . 0.0 109.467 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.91 -37.59 58.21 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.71 -8.71 58.75 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.329 -1.101 . . . . 0.0 108.17 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 69.0 41.16 1.48 Allowed 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.236 0.541 . . . . 0.0 110.844 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -73.4 148.44 88.23 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.196 -0.94 . . . . 0.0 108.789 177.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.29 170.25 18.75 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.301 2.001 . . . . 0.0 112.282 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.5 t -79.55 -1.74 39.16 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.46 -0.775 . . . . 0.0 109.4 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 24.4 m -65.06 -33.97 77.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.504 -0.748 . . . . 0.0 110.652 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.532 HD11 ' H ' ' A' ' 50' ' ' ALA . 86.0 mt -92.76 98.89 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 120.637 -1.289 . . . . 0.0 109.263 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 31.9 p -72.21 -30.49 64.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.077 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.4 m -97.5 45.19 1.03 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.496 -0.752 . . . . 0.0 109.43 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -59.55 3.34 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.113 -0.992 . . . . 0.0 108.868 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.489 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.18 -50.55 15.57 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.197 -0.939 . . . . 0.0 109.633 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.466 ' O ' ' OG1' ' A' ' 100' ' ' THR . 7.4 tp -58.19 -43.75 87.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.681 -1.262 . . . . 0.0 109.023 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.1 m -62.5 -40.76 97.77 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.055 -1.028 . . . . 0.0 108.822 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 95' ' ' ALA . 9.3 mt -69.3 -42.87 74.87 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.562 -0.711 . . . . 0.0 110.252 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.764 ' NH1' HD21 ' A' ' 129' ' ' ASN . 46.4 ttp180 -69.24 -50.11 50.11 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.155 -0.966 . . . . 0.0 110.859 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -54.31 -54.58 38.36 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.026 -1.046 . . . . 0.0 109.419 -179.015 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -62.86 -41.19 99.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.16 -0.962 . . . . 0.0 111.468 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.744 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.5 t80 -58.16 -43.93 87.65 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 119.826 -1.796 . . . . 0.0 109.153 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.658 ' HG2' HD21 ' A' ' 122' ' ' LEU . 86.3 mtp -51.96 -56.52 13.69 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.78 -0.575 . . . . 0.0 112.097 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.1 mttm -73.48 -51.08 18.38 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.517 -1.364 . . . . 0.0 112.553 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.53 ' C ' HD12 ' A' ' 106' ' ' LEU . 69.7 m-85 -85.49 -48.1 9.28 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -174.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.8 mp -97.5 -1.51 43.93 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.23 -1.544 . . . . 0.0 113.433 -176.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.656 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 66.2 t80 -64.15 -36.06 18.06 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 119.865 -1.772 . . . . 0.0 109.709 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 10.6 Cg_exo -66.81 -51.73 0.83 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 C-N-CA 121.801 1.667 . . . . 0.0 111.213 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -58.03 -50.29 73.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.233 -0.917 . . . . 0.0 109.271 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.45 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 85.9 tt0 -65.67 -43.94 87.76 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.296 -0.878 . . . . 0.0 110.843 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.3 -45.31 18.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.983 . . . . 0.0 110.422 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 108' ' ' PRO . 32.0 tt0 -67.65 -51.87 44.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.269 -0.894 . . . . 0.0 111.417 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -75.33 -29.62 60.03 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -0.97 . . . . 0.0 111.961 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.504 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.5 tptp -123.33 -28.92 3.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.972 -1.08 . . . . 0.0 111.852 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 30.0 t30 57.86 46.02 17.51 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.742 -1.224 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.504 HD21 ' HG2' ' A' ' 114' ' ' LYS . 93.7 mt -65.86 -31.79 72.94 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.917 -1.114 . . . . 0.0 110.94 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.595 ' OG ' ' N ' ' A' ' 118' ' ' THR . 10.7 t -153.91 -167.01 2.53 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 119.001 -1.08 . . . . 0.0 111.192 -178.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.595 ' N ' ' OG ' ' A' ' 117' ' ' SER . 53.9 p -129.35 155.55 79.86 Favored Pre-proline 0 N--CA 1.5 2.054 0 O-C-N 121.474 -0.766 . . . . 0.0 110.583 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -49.91 -43.19 42.37 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 122.106 1.871 . . . . 0.0 112.42 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.14 88.58 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.789 -1.194 . . . . 0.0 109.371 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.442 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -65.97 -45.61 81.08 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 103' ' ' MET . 44.2 tp -66.54 -53.42 35.04 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 110.415 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -56.03 -45.04 79.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.775 -1.203 . . . . 0.0 109.128 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.27 96.67 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.461 -0.775 . . . . 0.0 110.333 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.406 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.31 -35.79 78.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 108.686 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.528 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 24.3 mt -64.77 -48.04 86.14 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 CA-C-O 121.536 0.684 . . . . 0.0 109.189 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -65.71 -36.93 85.02 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.045 -1.034 . . . . 0.0 108.967 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -63.4 -32.88 85.65 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.764 HD21 ' NH1' ' A' ' 99' ' ' ARG . 10.9 p-10 -94.02 -31.52 14.2 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.886 -1.361 . . . . 0.0 110.305 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.623 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 48.3 mtp180 . . . . . 0 N--CA 1.494 1.746 0 O-C-N 120.926 -1.109 . . . . 0.0 109.948 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.937 ' O ' HG12 ' A' ' 13' ' ' VAL . 33.5 mt-30 . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.908 0.385 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -55.54 -45.96 77.17 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.927 -1.108 . . . . 0.0 109.0 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -61.32 -41.34 96.84 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.821 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -66.32 -53.22 38.93 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.42 -0.8 . . . . 0.0 111.378 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.937 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.0 p -70.04 -35.49 64.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.084 -1.01 . . . . 0.0 110.688 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HG2' HH11 ' A' ' 14' ' ' ARG . 1.1 tpt180 -62.18 -36.08 80.78 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 119.761 -1.837 . . . . 0.0 107.864 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -59.32 -32.58 70.2 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HA ' HD12 ' A' ' 19' ' ' ILE . 8.2 mt -63.03 -39.12 93.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.345 -0.847 . . . . 0.0 110.648 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -80.46 -36.31 33.71 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.565 -1.335 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' A' ' 14' ' ' ARG . 76.5 mm-40 -65.23 -30.05 70.9 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.903 -1.123 . . . . 0.0 111.024 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.687 HG21 HH12 ' A' ' 25' ' ' ARG . 15.5 mt -38.13 -39.01 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 O-C-N 121.506 -0.746 . . . . 0.0 111.061 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -170.3 163.11 8.75 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.563 -1.336 . . . . 0.0 110.785 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -90.04 67.06 6.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.775 -0.578 . . . . 0.0 110.494 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.408 ' OD1' ' C ' ' A' ' 22' ' ' ASP . 51.7 t0 -111.98 99.46 45.78 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -49.62 -47.62 22.2 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.392 2.061 . . . . 0.0 112.845 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -37.65 80.14 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.035 -1.041 . . . . 0.0 108.951 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.687 HH12 HG21 ' A' ' 19' ' ' ILE . 66.0 ttt180 -60.34 -36.82 78.85 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.263 -0.898 . . . . 0.0 109.46 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.57 -50.46 73.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.189 -0.945 . . . . 0.0 109.177 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -53.41 -36.92 62.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 109.288 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.72 -61.72 2.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.51 -0.744 . . . . 0.0 110.926 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 65.1 mt -53.75 -48.21 69.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.449 -0.782 . . . . 0.0 110.204 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 78.6 m-20 -59.83 -51.73 68.49 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.39 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -65.92 -42.15 90.48 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.966 -1.084 . . . . 0.0 109.794 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.64 -51.26 70.23 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.006 -1.059 . . . . 0.0 110.28 -178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CE2' HG23 ' A' ' 13' ' ' VAL . 46.3 m-85 -60.21 -34.59 73.86 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 118.441 -1.303 . . . . 0.0 108.01 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.6 m -67.48 -54.03 23.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.819 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -60.3 -39.48 87.1 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.178 -0.952 . . . . 0.0 109.958 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 76.4 mmm -58.72 -42.53 88.94 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.441 -0.787 . . . . 0.0 110.717 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.0 -35.53 81.49 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.892 -1.13 . . . . 0.0 109.726 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -59.0 -53.45 58.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.213 -0.929 . . . . 0.0 109.722 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.477 HH11 ' HB3' ' A' ' 108' ' ' PRO . 25.7 mtp180 -64.53 -18.04 64.47 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.503 -0.748 . . . . 0.0 111.626 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.57 5.09 60.37 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 107.817 -2.113 . . . . 0.0 107.817 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.9 p -115.62 83.74 11.58 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -87.12 146.44 7.63 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.898 2.398 . . . . 0.0 111.286 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.96 99.11 4.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 120.869 -1.144 . . . . 0.0 109.185 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.503 ' CB ' HH21 ' A' ' 45' ' ' ARG . 92.7 m-20 -64.99 -49.84 68.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.148 -0.97 . . . . 0.0 109.108 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.503 HH21 ' CB ' ' A' ' 44' ' ' ASN . 7.7 mtm180 -135.56 137.26 41.84 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.305 -0.872 . . . . 0.0 108.832 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 16' ' ' LEU . 17.9 mt -71.9 141.96 84.98 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 120.951 -1.093 . . . . 0.0 109.368 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -71.16 108.16 2.28 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 121.483 1.455 . . . . 0.0 109.785 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.52 HG23 ' N ' ' A' ' 52' ' ' SER . 49.9 mt -76.92 143.22 13.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 110.298 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.604 ' SD ' HG21 ' A' ' 97' ' ' THR . 28.8 mmm -137.55 124.63 21.54 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.09 41.08 8.47 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.6 mttp 60.5 23.03 12.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.982 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.52 ' N ' HG23 ' A' ' 48' ' ' ILE . 50.9 m -136.42 153.01 51.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.102 -0.999 . . . . 0.0 109.59 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.457 HG13 ' H ' ' A' ' 53' ' ' VAL . 1.1 m -65.94 143.57 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 108.895 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 59' ' ' LEU . 33.7 tp -75.12 122.45 23.61 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.076 -1.015 . . . . 0.0 109.554 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.04 97.16 0.08 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.423 -0.798 . . . . 0.0 109.022 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.7 mt -58.59 -27.98 65.14 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.3 -0.875 . . . . 0.0 109.138 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -80.27 -62.18 1.76 Allowed 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.863 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -55.51 -37.14 67.48 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.692 -1.255 . . . . 0.0 110.075 -178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 54' ' ' LEU . 19.4 tp -63.11 -45.2 93.15 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.433 ' CE2' HG13 ' A' ' 64' ' ' ILE . 63.4 t80 -62.16 -66.57 0.52 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 60' ' ' TYR . 50.7 t-20 -42.54 -37.7 1.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.612 -0.68 . . . . 0.0 109.355 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.878 HD22 HH22 ' A' ' 66' ' ' ARG . 11.5 mt -70.36 -48.58 55.67 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 102' ' ' TYR . 30.4 t -55.58 -42.17 67.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.256 -0.903 . . . . 0.0 110.051 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.433 HG13 ' CE2' ' A' ' 60' ' ' TYR . 10.9 mm -71.16 -33.59 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 120.795 -1.19 . . . . 0.0 107.888 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.53 -19.38 24.62 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.738 -0.785 . . . . 0.0 109.56 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.878 HH22 HD22 ' A' ' 62' ' ' LEU . 13.4 mmt-85 -96.79 -3.24 42.64 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.736 -1.228 . . . . 0.0 108.273 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 13.16 71.78 Favored Glycine 0 N--CA 1.491 2.341 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.059 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.07 131.45 2.45 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.297 -1.707 . . . . 0.0 111.714 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.733 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.6 tp -50.2 -41.21 49.19 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.589 -0.947 . . . . 0.0 109.998 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.425 HG22 ' HA ' ' A' ' 122' ' ' LEU . 80.0 t -61.49 -43.15 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.148 -0.97 . . . . 0.0 109.732 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -55.24 -38.8 68.97 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.971 -1.08 . . . . 0.0 108.862 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.637 ' O ' ' N ' ' A' ' 76' ' ' LYS . 47.0 t -64.22 -42.55 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.653 -0.654 . . . . 0.0 109.587 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.483 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 95.1 mt -65.38 -59.06 4.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.68 0 O-C-N 121.052 -1.03 . . . . 0.0 110.679 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -58.26 -40.58 82.21 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.104 -0.998 . . . . 0.0 110.4 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.7 mmtt -93.14 -12.22 30.94 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.211 -0.931 . . . . 0.0 110.855 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.637 ' N ' ' O ' ' A' ' 72' ' ' VAL . 15.1 mtmt 59.67 62.68 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.252 -0.905 . . . . 0.0 110.102 -178.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.1 14.33 24.21 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.094 -1.004 . . . . 0.0 108.627 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.523 ' NE1' HG12 ' A' ' 72' ' ' VAL . 81.8 m95 -63.44 -39.22 93.91 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.291 -0.881 . . . . 0.0 109.341 179.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.4 mm-40 -49.31 -38.29 27.12 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.651 -1.281 . . . . 0.0 108.28 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.599 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.9 mm-40 -70.53 -42.2 71.54 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.427 HG12 ' NH2' ' A' ' 66' ' ' ARG . 3.7 mt -67.34 -54.73 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' A' ' 95' ' ' ALA . 58.5 mt -53.37 -53.6 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.575 -0.703 . . . . 0.0 109.973 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -65.81 -41.31 92.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.014 -1.054 . . . . 0.0 109.627 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.48 -32.72 46.08 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.2 mt -88.93 -8.48 54.1 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.379 -1.071 . . . . 0.0 108.991 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 65.32 40.8 4.64 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 109.935 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.2 mt -73.42 119.21 74.67 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.341 -0.85 . . . . 0.0 109.385 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.465 ' C ' ' H ' ' A' ' 90' ' ' SER . 52.0 Cg_exo -48.44 141.96 18.36 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 121.719 1.613 . . . . 0.0 112.229 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.8 p -59.58 -1.61 0.26 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.286 -0.884 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 88' ' ' PRO . 83.8 p -66.45 -22.9 66.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.168 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.521 HD13 ' SD ' ' A' ' 49' ' ' MET . 71.2 mt -97.78 107.48 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 120.803 -1.185 . . . . 0.0 109.46 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.5 p -78.48 -28.12 46.39 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.8 m -88.67 29.58 0.99 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.675 -0.64 . . . . 0.0 109.358 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.67 -66.64 0.46 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.508 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.8 -53.5 31.45 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.457 -0.777 . . . . 0.0 109.501 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.8 tp -57.36 -45.43 84.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 109.049 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.604 HG21 ' SD ' ' A' ' 49' ' ' MET . 49.6 m -60.2 -40.34 89.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.155 -0.966 . . . . 0.0 108.744 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.425 HD22 HD13 ' A' ' 59' ' ' LEU . 10.9 mt -70.8 -47.16 60.94 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.493 -0.754 . . . . 0.0 110.009 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.507 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 39.8 ttm180 -62.89 -51.87 65.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.003 -1.061 . . . . 0.0 111.3 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.1 m -56.7 -54.84 41.53 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.05 -1.031 . . . . 0.0 110.531 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.56 -41.87 99.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.359 -0.838 . . . . 0.0 111.264 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.867 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.5 t80 -57.88 -40.53 80.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.576 -1.328 . . . . 0.0 109.521 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.548 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -52.82 -55.32 23.88 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.415 -0.803 . . . . 0.0 110.999 -178.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -73.36 -53.37 10.93 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.874 -1.141 . . . . 0.0 112.882 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -84.6 -46.99 10.99 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -174.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.631 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.3 mp -97.45 -8.7 28.74 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.148 -1.595 . . . . 0.0 114.23 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.655 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 14.3 t80 -60.49 -38.37 56.65 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 119.725 -1.859 . . . . 0.0 109.099 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 52.5 Cg_exo -58.7 -59.74 0.44 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.578 2.186 . . . . 0.0 112.81 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -59.17 -40.86 86.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.614 -0.679 . . . . 0.0 109.518 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -69.99 -46.03 66.05 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.457 -0.777 . . . . 0.0 110.4 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ASN . 17.0 t -76.99 -45.62 26.72 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.234 -0.916 . . . . 0.0 109.912 -179.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -66.3 -49.81 65.78 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.245 -0.909 . . . . 0.0 111.266 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 28.9 mmtm -74.2 -29.34 61.7 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.971 -1.081 . . . . 0.0 111.545 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.576 ' HG2' HD21 ' A' ' 116' ' ' LEU . 19.6 tptp -125.04 -28.11 3.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.897 -1.127 . . . . 0.0 111.703 -177.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 111' ' ' CYS . 55.1 t30 56.28 47.5 19.08 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.666 -1.271 . . . . 0.0 110.619 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 114' ' ' LYS . 61.8 mt -69.02 -30.06 68.37 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.178 -0.951 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 8.1 t -154.16 -165.94 2.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.017 -1.052 . . . . 0.0 111.092 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 70.6 p -130.48 155.49 81.01 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.562 -0.711 . . . . 0.0 109.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.54 -40.09 64.08 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.862 1.708 . . . . 0.0 112.526 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.99 89.24 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.836 -1.165 . . . . 0.0 109.384 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -66.36 -42.71 87.66 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.548 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.3 tp -68.75 -51.45 41.11 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.557 -0.714 . . . . 0.0 110.212 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -58.94 -45.08 91.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.936 -1.103 . . . . 0.0 109.365 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.66 -42.46 98.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.131 -0.981 . . . . 0.0 110.327 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.91 -32.21 72.53 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 122.094 0.95 . . . . 0.0 108.728 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.437 ' CD1' ' HE2' ' A' ' 103' ' ' MET . 4.9 mt -64.53 -51.4 68.27 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -63.72 -38.77 92.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 109.381 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -59.9 -34.02 81.13 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.676 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -93.46 -35.49 12.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.138 -1.213 . . . . 0.0 110.117 -179.329 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.676 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.9 mtp180 . . . . . 0 N--CA 1.492 1.665 0 O-C-N 120.933 -1.104 . . . . 0.0 109.735 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.621 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.3 mt-30 . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -49.73 -50.52 43.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -62.58 -37.2 85.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.108 -0.995 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.43 -52.64 51.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.979 -1.075 . . . . 0.0 111.969 -178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -68.87 -33.85 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 120.824 -1.173 . . . . 0.0 110.567 -179.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -67.32 -36.4 81.4 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.053 -1.655 . . . . 0.0 108.702 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.442 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 12.3 mm-40 -59.16 -28.98 67.1 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 46' ' ' LEU . 10.4 mt -67.66 -42.32 82.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.398 -0.814 . . . . 0.0 111.634 -179.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.8 m-85 -76.32 -33.75 59.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.37 -1.456 . . . . 0.0 109.634 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.496 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.7 mm-40 -62.62 -31.56 72.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.025 -1.047 . . . . 0.0 110.243 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.601 HD13 ' NH2' ' A' ' 25' ' ' ARG . 32.2 mt -36.98 -40.69 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.737 -0.602 . . . . 0.0 110.312 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.24 161.37 5.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.857 -1.152 . . . . 0.0 110.256 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -92.13 73.78 5.47 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -110.93 137.51 20.88 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -71.78 -62.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.251 1.967 . . . . 0.0 112.643 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -58.0 -33.64 69.15 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.056 -1.027 . . . . 0.0 109.276 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.601 ' NH2' HD13 ' A' ' 19' ' ' ILE . 58.0 ttt180 -61.87 -41.08 97.44 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.862 -1.149 . . . . 0.0 109.994 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -59.8 -59.57 5.22 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.016 -1.052 . . . . 0.0 109.883 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 7.8 pt-20 -53.15 -29.85 33.72 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.551 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -64.55 -61.98 1.87 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.06 . . . . 0.0 109.996 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 16' ' ' LEU . 55.1 mt -53.63 -45.88 70.28 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.349 -0.844 . . . . 0.0 109.557 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -65.56 -49.52 68.57 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.519 -179.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.599 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 57.2 t0 -64.87 -39.85 94.19 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.189 -0.945 . . . . 0.0 109.001 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.7 tp -60.76 -49.7 76.44 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.155 -1.018 . . . . 0.0 109.058 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.618 ' CE1' HD12 ' A' ' 43' ' ' ILE . 47.7 m-85 -61.55 -35.3 77.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.6 t -68.08 -54.49 17.82 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.523 -0.735 . . . . 0.0 109.576 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.91 -40.85 85.76 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.227 -0.92 . . . . 0.0 109.722 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.418 ' CE ' ' O ' ' A' ' 41' ' ' THR . 75.2 mmm -60.36 -38.15 82.94 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.577 -0.702 . . . . 0.0 110.013 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -61.85 -39.19 90.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.125 -0.985 . . . . 0.0 109.375 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -64.43 -50.53 67.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.923 . . . . 0.0 111.292 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.463 ' HE ' ' HB2' ' A' ' 108' ' ' PRO . 0.9 OUTLIER -63.69 -18.84 64.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.931 -1.106 . . . . 0.0 111.421 -177.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 4.18 61.36 Favored Glycine 0 N--CA 1.482 1.736 0 N-CA-C 107.746 -2.142 . . . . 0.0 107.746 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.418 ' O ' ' CE ' ' A' ' 36' ' ' MET . 19.4 p -114.62 83.38 8.85 Favored Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.37 151.38 13.56 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.729 2.286 . . . . 0.0 111.235 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.618 HD12 ' CE1' ' A' ' 33' ' ' PHE . 18.3 mt -89.11 103.46 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 110.724 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 4.0 m120 -63.54 -74.51 0.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -116.56 135.26 53.96 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.552 HD22 HD11 ' A' ' 16' ' ' LEU . 5.6 mt -69.15 144.43 95.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.224 -179.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -65.82 134.88 39.2 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 121.2 1.267 . . . . 0.0 108.974 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' SER . 6.1 mt -102.37 145.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.024 -1.048 . . . . 0.0 110.242 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 75.6 mtp -142.73 119.3 11.04 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 71.8 39.13 0.88 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.4 mttm 59.77 24.27 13.21 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.242 0.544 . . . . 0.0 109.79 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.8 159.42 42.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.376 -0.827 . . . . 0.0 109.267 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 148.19 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.001 -1.062 . . . . 0.0 109.738 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.597 HD13 ' SD ' ' A' ' 49' ' ' MET . 63.6 tp -76.17 121.23 22.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.508 -0.745 . . . . 0.0 109.668 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.417 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.8 m-20 -65.04 93.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.378 -0.826 . . . . 0.0 109.162 -179.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.9 mt -56.15 -25.22 45.52 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.287 -0.883 . . . . 0.0 109.341 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -81.32 -58.74 2.91 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.2 -0.938 . . . . 0.0 111.759 -179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.37 -36.81 71.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.417 -1.427 . . . . 0.0 109.257 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.551 HD22 HD21 ' A' ' 54' ' ' LEU . 53.0 tp -61.63 -47.48 85.22 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.452 ' O ' ' C ' ' A' ' 61' ' ' ASN . 56.2 t80 -58.81 -70.09 0.16 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 60' ' ' TYR . 63.2 t30 -40.48 -39.31 0.99 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.443 -0.786 . . . . 0.0 109.708 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.521 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 6.1 mt -67.6 -50.73 56.83 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.815 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -57.01 -42.41 79.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.696 -0.628 . . . . 0.0 110.256 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.494 HG23 HD11 ' A' ' 116' ' ' LEU . 5.2 mm -70.15 -29.03 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 62' ' ' LEU . . . -56.21 -29.49 61.03 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.547 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.687 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.1 mmt180 -91.61 -4.41 55.31 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.612 -1.305 . . . . 0.0 108.78 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.66 19.63 59.61 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.332 177.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.42 130.31 2.47 Favored Glycine 0 N--CA 1.498 2.811 0 O-C-N 120.28 -1.718 . . . . 0.0 111.475 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.569 HD11 ' HH2' ' A' ' 78' ' ' TRP . 10.7 tp -50.44 -39.76 48.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.584 -0.951 . . . . 0.0 110.464 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 122' ' ' LEU . 60.1 t -57.02 -43.36 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.006 -1.059 . . . . 0.0 109.691 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -57.68 -39.38 77.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.863 -1.148 . . . . 0.0 109.448 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.6 t -62.38 -42.24 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.365 -0.834 . . . . 0.0 109.516 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.8 mt -66.41 -55.66 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 120.851 -1.156 . . . . 0.0 110.692 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -57.17 -42.0 80.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.02 -1.05 . . . . 0.0 110.351 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -94.58 -8.74 37.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.254 -0.904 . . . . 0.0 110.596 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.618 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.9 mttp 57.3 59.11 3.5 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.291 -0.881 . . . . 0.0 109.513 -177.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -88.29 12.89 12.8 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.011 -1.076 . . . . 0.0 108.77 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.569 ' HH2' HD11 ' A' ' 69' ' ' LEU . 71.3 m95 -63.24 -41.04 99.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.16 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' TRP . 15.5 mm100 -49.37 -38.7 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.292 -1.505 . . . . 0.0 108.53 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.687 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.7 mm-40 -71.32 -45.87 61.98 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 108.896 178.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.448 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.8 mt -64.69 -51.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.625 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.9 mt -52.35 -54.75 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -66.64 -40.93 88.92 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.138 -0.976 . . . . 0.0 109.555 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.44 -32.29 37.66 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.4 mt -89.84 -7.88 53.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.402 -1.058 . . . . 0.0 108.801 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 64.66 42.06 4.94 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.604 -0.685 . . . . 0.0 110.618 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.5 mt -74.42 142.54 78.23 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.081 -1.012 . . . . 0.0 109.224 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 51.7 Cg_endo -72.13 142.16 37.52 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.158 1.906 . . . . 0.0 112.163 179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.1 t -56.49 0.99 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 109.761 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 19.4 m -65.8 -31.35 72.28 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.107 -0.995 . . . . 0.0 109.838 -178.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.625 HD11 ' H ' ' A' ' 50' ' ' ALA . 83.2 mt -93.93 98.26 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 120.822 -1.174 . . . . 0.0 109.486 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.9 p -69.84 -27.94 65.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 108.735 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.9 m -91.23 32.67 1.02 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.519 -0.738 . . . . 0.0 109.164 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.37 -65.52 0.68 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.09 -1.006 . . . . 0.0 108.727 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.625 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.77 -52.05 34.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 109.216 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.53 -43.51 89.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.861 -1.149 . . . . 0.0 109.055 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.6 m -60.56 -39.9 89.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.058 -1.026 . . . . 0.0 108.642 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.458 HD22 HD13 ' A' ' 59' ' ' LEU . 10.4 mt -70.2 -46.72 63.99 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.594 -0.691 . . . . 0.0 110.304 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.497 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 36.9 ttm180 -66.63 -50.92 61.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.066 . . . . 0.0 111.004 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.1 m -55.88 -50.99 69.13 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.967 -1.093 . . . . 0.0 109.026 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -64.31 -43.67 93.99 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.093 -1.005 . . . . 0.0 111.503 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.75 -41.01 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.274 -1.516 . . . . 0.0 108.859 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.908 ' SD ' HD21 ' A' ' 122' ' ' LEU . 42.9 mmm -51.97 -59.49 4.28 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.677 -0.639 . . . . 0.0 111.357 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -50.38 21.37 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.543 -1.348 . . . . 0.0 113.196 -177.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 106' ' ' LEU . 57.6 m-85 -82.0 -47.0 13.19 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -174.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.65 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.3 mp -104.28 6.19 35.2 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.394 -1.441 . . . . 0.0 114.044 -176.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.507 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 48.1 t80 -65.05 -40.29 44.56 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 119.892 -1.755 . . . . 0.0 111.475 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 83.5 Cg_endo -77.79 -40.98 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 121.687 1.591 . . . . 0.0 113.317 -179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.59 -43.52 89.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.884 -1.135 . . . . 0.0 108.109 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -68.27 -54.61 16.36 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.517 -0.739 . . . . 0.0 109.932 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' A' ' 115' ' ' ASN . 91.8 m -70.62 -43.15 69.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.866 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.475 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 40.0 tp10 -67.09 -49.5 64.82 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.715 -1.24 . . . . 0.0 110.83 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -76.18 -27.28 56.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.044 -1.035 . . . . 0.0 111.036 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HG2' HD21 ' A' ' 116' ' ' LEU . 43.6 tptt -125.12 -27.3 3.55 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.974 -1.079 . . . . 0.0 111.954 -177.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.568 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.4 t30 58.72 45.23 16.05 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.523 -1.361 . . . . 0.0 110.376 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.494 HD11 HG23 ' A' ' 64' ' ' ILE . 87.4 mt -67.82 -32.0 72.25 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.037 -1.04 . . . . 0.0 110.871 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.47 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 26.0 t -153.23 -167.71 2.8 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 119.009 -1.076 . . . . 0.0 111.292 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 81.2 p -124.5 161.61 47.14 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.605 -0.684 . . . . 0.0 110.137 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.507 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 23.3 Cg_exo -59.83 -40.97 58.53 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.602 1.535 . . . . 0.0 112.36 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.77 -37.11 86.15 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.143 -0.973 . . . . 0.0 109.871 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.47 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.69 -46.19 73.01 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.908 HD21 ' SD ' ' A' ' 103' ' ' MET . 11.4 tp -66.47 -52.08 49.96 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.485 -0.759 . . . . 0.0 109.879 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.25 -45.84 87.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.129 -0.982 . . . . 0.0 109.629 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.41 87.78 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.25 -0.906 . . . . 0.0 109.873 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.33 -33.33 74.11 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.231 -0.918 . . . . 0.0 108.907 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.595 HD11 ' SD ' ' A' ' 103' ' ' MET . 8.0 mt -65.44 -48.96 81.05 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -64.0 -38.72 92.1 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.446 -0.784 . . . . 0.0 109.138 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.5 -34.08 84.17 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -95.14 -35.19 11.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.122 -1.222 . . . . 0.0 110.598 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 53.7 mtp180 . . . . . 0 N--CA 1.494 1.735 0 O-C-N 120.75 -1.218 . . . . 0.0 109.69 178.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.761 ' O ' HG13 ' A' ' 13' ' ' VAL . 2.0 mp0 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.182 0.515 . . . . 0.0 109.851 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.31 -50.9 68.39 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.121 -0.987 . . . . 0.0 109.811 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -62.03 -45.08 95.17 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.09 -1.006 . . . . 0.0 109.66 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -63.71 -47.84 79.52 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.378 -0.826 . . . . 0.0 110.278 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.761 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -72.78 -36.46 52.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 O-C-N 120.644 -1.285 . . . . 0.0 108.567 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.43 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -56.93 -40.16 75.85 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.492 -1.38 . . . . 0.0 107.761 178.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.441 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.1 OUTLIER -58.79 -30.47 67.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.431 -0.908 . . . . 0.0 108.607 178.247 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.459 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.1 mt -71.72 -39.18 70.31 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.415 -0.803 . . . . 0.0 111.661 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -76.47 -32.83 58.61 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.402 -1.436 . . . . 0.0 110.29 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.467 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -66.52 -25.85 66.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.899 -1.126 . . . . 0.0 110.386 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 HH21 ' A' ' 25' ' ' ARG . 30.3 mt -38.96 -39.72 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 O-C-N 121.605 -0.684 . . . . 0.0 110.397 -179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.2 m120 -171.33 161.84 6.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.739 -1.226 . . . . 0.0 110.315 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -90.5 65.16 6.02 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.47 0.653 . . . . 0.0 109.3 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -111.9 103.22 55.04 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.502 -0.749 . . . . 0.0 109.136 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -47.83 -43.47 29.2 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.015 1.81 . . . . 0.0 111.957 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -61.62 -38.48 87.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.19 -0.944 . . . . 0.0 108.535 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.679 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -60.36 -44.53 95.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.5 -0.75 . . . . 0.0 109.389 179.89 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.3 -53.54 53.59 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 0.0 109.77 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -52.74 -39.05 61.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.432 -0.793 . . . . 0.0 109.175 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -61.12 -63.01 1.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.325 -0.859 . . . . 0.0 109.858 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.585 HD11 ' NH1' ' A' ' 25' ' ' ARG . 43.7 mt -56.2 -44.72 79.75 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.585 -0.697 . . . . 0.0 109.521 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -61.93 -46.53 88.94 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.704 -0.798 . . . . 0.0 109.121 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -66.59 -42.91 86.21 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.7 tp -61.07 -49.3 77.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 0.0 110.658 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -60.43 -36.44 78.19 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.284 -1.51 . . . . 0.0 107.528 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.3 t -69.93 -53.27 18.64 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.508 -0.745 . . . . 0.0 109.478 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 76.6 t80 -58.73 -42.38 88.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 111.17 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.446 ' CE ' ' O ' ' A' ' 41' ' ' THR . 63.4 mmm -56.49 -38.2 71.41 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.142 -0.974 . . . . 0.0 110.915 -178.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -55.68 -40.18 71.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.765 -1.209 . . . . 0.0 108.499 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -64.91 -39.54 93.67 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.884 0.85 . . . . 0.0 108.739 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.406 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 21.8 mmm180 -64.31 -30.52 71.57 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.522 -0.736 . . . . 0.0 109.265 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.26 -0.83 60.3 Favored Glycine 0 N--CA 1.485 1.948 0 N-CA-C 108.152 -1.979 . . . . 0.0 108.152 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.446 ' O ' ' CE ' ' A' ' 36' ' ' MET . 44.9 p -120.27 84.37 34.44 Favored Pre-proline 0 N--CA 1.488 1.445 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.76 141.93 11.1 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.439 2.093 . . . . 0.0 110.915 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.4 mt -78.8 101.23 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 120.928 -1.107 . . . . 0.0 110.159 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.494 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 3.1 m120 -82.91 -4.09 57.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.626 ' NE ' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -170.4 124.45 0.71 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.43 HD22 HD11 ' A' ' 16' ' ' LEU . 2.3 mt -73.09 147.56 88.3 Favored Pre-proline 0 C--N 1.291 -1.971 0 O-C-N 121.412 -0.805 . . . . 0.0 109.243 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -73.78 133.45 18.57 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.526 1.484 . . . . 0.0 108.999 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 42.2 mt -101.0 142.51 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.777 -1.202 . . . . 0.0 110.509 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.744 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.0 mtp -135.07 121.69 20.72 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.585 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.48 41.42 3.2 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -178.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 56.94 22.84 7.58 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.369 0.604 . . . . 0.0 109.681 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -132.79 148.44 52.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.399 -0.813 . . . . 0.0 109.14 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 10.2 m -67.0 145.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.895 -1.128 . . . . 0.0 108.955 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.744 HD13 ' SD ' ' A' ' 49' ' ' MET . 36.9 tp -77.11 122.57 25.17 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.307 -0.871 . . . . 0.0 109.795 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -65.84 90.96 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.525 -0.735 . . . . 0.0 109.565 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.3 -24.33 28.08 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 120.877 -1.139 . . . . 0.0 109.438 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.592 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 43.6 t80 -77.98 -59.35 2.82 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.227 -0.92 . . . . 0.0 111.654 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -60.22 -38.36 83.15 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.834 -1.166 . . . . 0.0 110.615 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.499 HD13 HD22 ' A' ' 98' ' ' LEU . 32.1 tp -58.5 -45.03 89.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 43.7 t80 -57.04 -68.43 0.23 Allowed 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.662 ' N ' HD22 ' A' ' 61' ' ' ASN . 1.2 m120 -39.91 -42.21 1.3 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.613 -0.679 . . . . 0.0 111.142 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.609 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.7 mt -69.47 -44.31 71.44 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.116 -1.433 . . . . 0.0 107.314 179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.811 HG21 ' CE2' ' A' ' 102' ' ' TYR . 34.8 t -58.43 -44.04 87.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 121.261 -0.9 . . . . 0.0 110.288 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.545 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 1.2 mm -69.42 -34.11 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.386 -1.446 . . . . 0.0 107.986 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.11 28.02 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 120.096 -0.641 . . . . 0.0 109.562 -178.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.632 HH21 ' CB ' ' A' ' 80' ' ' GLU . 7.5 mmt-85 -92.95 -4.39 52.81 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.678 -1.264 . . . . 0.0 108.898 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 19.05 62.63 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.058 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.23 128.17 2.19 Favored Glycine 0 N--CA 1.5 2.942 0 O-C-N 120.342 -1.681 . . . . 0.0 111.815 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 102' ' ' TYR . 8.1 tp -48.93 -39.34 25.87 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.601 -0.941 . . . . 0.0 109.723 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' A' ' 122' ' ' LEU . 92.8 t -58.82 -43.11 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 109.805 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -56.01 -40.78 73.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.0 109.208 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 48.0 t -60.97 -43.95 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.392 -0.818 . . . . 0.0 109.216 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 88.4 mt -66.57 -56.36 14.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 O-C-N 121.043 -1.036 . . . . 0.0 110.572 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.75 -42.83 79.98 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.991 -1.068 . . . . 0.0 110.322 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -93.28 -8.97 40.63 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.089 -1.007 . . . . 0.0 110.223 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 24.3 mtmm 57.93 60.71 2.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 0.0 109.387 -178.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.0 mt -91.2 14.76 13.39 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.466 ' CE2' HG12 ' A' ' 72' ' ' VAL . 83.0 m95 -63.73 -39.79 95.17 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.389 -0.82 . . . . 0.0 109.132 179.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' C ' ' O ' ' A' ' 78' ' ' TRP . 77.6 mm-40 -50.49 -39.09 47.45 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.456 -1.403 . . . . 0.0 108.252 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.632 ' CB ' HH21 ' A' ' 66' ' ' ARG . 97.6 mt-10 -69.62 -43.14 73.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.45 -51.96 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 95' ' ' ALA . 85.6 mt -52.36 -51.59 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -0.884 . . . . 0.0 108.866 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.11 -41.63 85.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.198 -0.939 . . . . 0.0 109.688 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.05 -31.53 40.55 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.3 mt -89.38 -8.83 52.31 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.477 -1.014 . . . . 0.0 109.004 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 61.49 40.4 13.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -73.46 141.15 79.7 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.8 Cg_endo -67.48 138.37 45.81 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 121.884 1.723 . . . . 0.0 112.155 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.7 t -56.1 -0.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.297 -0.877 . . . . 0.0 110.035 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 16.0 m -64.87 -30.82 71.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 109.718 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.585 HD11 ' H ' ' A' ' 50' ' ' ALA . 68.7 mt -93.22 101.32 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.923 -1.111 . . . . 0.0 109.406 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -72.79 -28.02 62.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.076 -1.015 . . . . 0.0 108.662 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.4 m -89.56 30.05 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.409 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -60.06 -65.35 0.69 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.761 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.59 -52.62 29.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.451 -0.78 . . . . 0.0 109.607 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -58.79 -43.99 90.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.872 -1.142 . . . . 0.0 109.304 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 m -60.17 -38.63 83.79 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.097 -1.002 . . . . 0.0 108.597 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.499 HD22 HD13 ' A' ' 59' ' ' LEU . 9.8 mt -70.8 -46.5 62.72 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.614 -0.678 . . . . 0.0 109.85 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.531 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.0 ttm180 -65.87 -51.35 59.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 111.179 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.5 m -55.94 -53.39 57.39 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 110.108 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -63.09 -41.14 99.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.171 -0.956 . . . . 0.0 111.273 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.811 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.8 t80 -57.03 -41.44 78.62 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.112 -1.617 . . . . 0.0 109.447 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.608 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -55.94 -55.54 31.4 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.387 -0.82 . . . . 0.0 112.157 -178.612 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -70.94 -53.27 15.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 120.84 -1.163 . . . . 0.0 112.702 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.483 ' C ' HD12 ' A' ' 106' ' ' LEU . 55.7 m-85 -84.31 -44.6 13.67 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -175.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.1 mp -102.96 6.4 38.89 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.36 -1.463 . . . . 0.0 113.913 -176.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.576 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 49.0 t80 -62.42 -42.79 82.14 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 119.855 -1.778 . . . . 0.0 111.625 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 112' ' ' GLU . 95.4 Cg_endo -76.96 -41.87 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 121.473 1.448 . . . . 0.0 112.823 -178.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -57.32 -38.97 74.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.82 -1.175 . . . . 0.0 107.981 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.491 ' O ' ' OE1' ' A' ' 110' ' ' GLU . 4.7 tp10 -73.5 -54.8 7.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.608 -0.682 . . . . 0.0 110.282 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.577 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.1 m -73.02 -41.42 64.26 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.318 -0.864 . . . . 0.0 111.16 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.64 -44.8 80.99 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.706 -1.246 . . . . 0.0 110.587 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -74.66 -33.63 62.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.195 -0.941 . . . . 0.0 111.253 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HG2' HD21 ' A' ' 116' ' ' LEU . 4.1 tppt? -125.18 -24.37 4.01 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.938 -1.101 . . . . 0.0 111.773 -177.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 111' ' ' CYS . 17.3 t-20 57.01 44.94 21.97 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.631 -1.293 . . . . 0.0 110.23 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.6 mt -67.5 -29.62 69.09 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.089 -1.007 . . . . 0.0 110.828 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 118' ' ' THR . 46.5 t -152.66 -169.0 3.21 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.355 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.431 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.4 p -128.84 166.79 22.44 Favored Pre-proline 0 N--CA 1.498 1.974 0 O-C-N 121.593 -0.692 . . . . 0.0 109.61 -178.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -62.88 -40.4 35.54 Favored 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 121.382 1.388 . . . . 0.0 111.908 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.53 87.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.064 -1.023 . . . . 0.0 109.306 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.46 -45.63 79.08 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 178.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.608 HD21 ' HG3' ' A' ' 103' ' ' MET . 29.3 tp -66.17 -51.03 61.73 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.352 -0.842 . . . . 0.0 109.972 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -57.26 -46.99 82.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.081 -1.012 . . . . 0.0 109.647 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.498 ' O ' ' OD1' ' A' ' 127' ' ' ASP . . . -61.1 -41.02 95.91 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.299 -0.876 . . . . 0.0 110.082 -179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.63 -34.36 75.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 108.417 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.496 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 10.5 mt -63.94 -49.99 79.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.677 ' OD1' ' N ' ' A' ' 128' ' ' GLY . 18.9 p30 -65.75 -32.58 74.21 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 118.863 -1.135 . . . . 0.0 108.588 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.677 ' N ' ' OD1' ' A' ' 127' ' ' ASP . . . -65.61 -30.23 76.92 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.645 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.69 -35.99 14.6 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.004 -1.291 . . . . 0.0 110.741 -179.082 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.6 mtm180 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 120.783 -1.198 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.86 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.9 mt-30 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -48.24 -47.27 35.93 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.476 -0.765 . . . . 0.0 109.606 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -62.14 -41.85 98.67 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.162 -0.961 . . . . 0.0 108.687 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.78 -52.95 38.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.683 -0.635 . . . . 0.0 111.454 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.86 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.9 OUTLIER -71.47 -37.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.989 -1.069 . . . . 0.0 109.959 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.405 ' HB2' ' HE ' ' A' ' 14' ' ' ARG . 6.1 tpp180 -60.19 -39.5 86.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.083 -1.636 . . . . 0.0 108.214 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.401 HE21 ' HA ' ' A' ' 15' ' ' GLN . 7.4 mm-40 -58.3 -30.71 66.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.598 HD13 HD22 ' A' ' 29' ' ' LEU . 10.9 mt -68.08 -39.46 82.92 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.457 -0.777 . . . . 0.0 111.529 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 90.8 m-85 -77.52 -37.67 50.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.357 -1.464 . . . . 0.0 110.289 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.488 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.1 -27.82 69.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.119 -0.988 . . . . 0.0 111.132 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.644 HD13 ' NH2' ' A' ' 25' ' ' ARG . 16.5 mt -36.1 -40.18 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.592 -0.693 . . . . 0.0 110.578 -178.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.59 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.69 167.74 5.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.836 -1.165 . . . . 0.0 110.356 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 53.6 p30 -90.53 65.39 6.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.575 -0.703 . . . . 0.0 110.707 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.89 136.01 19.6 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.955 . . . . 0.0 108.46 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.503 ' O ' ' OE1' ' A' ' 27' ' ' GLU . 67.4 Cg_endo -75.72 -62.61 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.049 1.833 . . . . 0.0 112.656 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -55.02 -36.82 65.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.416 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.644 ' NH2' HD13 ' A' ' 19' ' ' ILE . 57.9 ttt180 -57.31 -38.42 73.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.221 -0.924 . . . . 0.0 109.765 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -60.12 -58.48 8.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.963 . . . . 0.0 109.763 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.503 ' OE1' ' O ' ' A' ' 23' ' ' PRO . 44.2 mp0 -53.4 -33.65 54.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.321 -0.862 . . . . 0.0 109.995 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -60.96 -63.19 1.38 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.155 -0.965 . . . . 0.0 110.896 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.598 HD22 HD13 ' A' ' 16' ' ' LEU . 28.1 mt -56.17 -45.44 79.72 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.037 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 38.4 m-20 -62.41 -46.21 89.62 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.599 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.95 -44.39 80.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.223 -0.923 . . . . 0.0 109.782 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.2 tp -56.51 -47.88 78.41 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 110.267 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.468 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.3 m-85 -61.23 -34.74 75.6 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.311 -1.356 . . . . 0.0 108.385 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 m -69.25 -55.13 11.43 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.274 -0.891 . . . . 0.0 110.457 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 43.0 t80 -60.36 -37.2 79.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.869 . . . . 0.0 110.921 -179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.5 mmm -59.44 -37.61 78.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.17 -0.956 . . . . 0.0 110.867 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -62.93 -39.76 95.56 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.962 -1.086 . . . . 0.0 110.82 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -63.39 -36.99 85.53 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.655 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -65.03 -29.04 69.91 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.386 -179.286 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.71 -1.76 63.97 Favored Glycine 0 C--N 1.295 -1.717 0 N-CA-C 107.44 -2.264 . . . . 0.0 107.44 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.4 p -116.93 84.02 15.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -86.59 143.18 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.684 2.256 . . . . 0.0 110.575 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.549 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 20.3 mt -78.73 99.44 3.09 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 120.866 -1.146 . . . . 0.0 109.389 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.481 ' HB3' HH12 ' A' ' 45' ' ' ARG . 89.7 m-20 -67.59 -38.11 83.55 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 178.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.642 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -144.28 130.56 19.72 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 178.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.503 HD23 HG21 ' A' ' 43' ' ' ILE . 7.3 mt -71.46 147.61 92.72 Favored Pre-proline 0 C--N 1.298 -1.647 0 O-C-N 121.287 -0.883 . . . . 0.0 109.504 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.41 138.69 33.25 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 121.685 1.59 . . . . 0.0 109.429 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.501 HG23 ' N ' ' A' ' 52' ' ' SER . 41.3 mt -104.41 143.14 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.044 -1.035 . . . . 0.0 110.379 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.618 ' SD ' HG21 ' A' ' 97' ' ' THR . 76.7 mmm -135.35 127.3 29.56 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.58 42.47 17.29 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.2 mttt 59.72 25.62 14.62 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.415 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.501 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.35 154.71 48.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.1 -1.0 . . . . 0.0 109.794 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.7 m -67.16 144.24 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 120.939 -1.101 . . . . 0.0 109.263 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.509 HD21 HD22 ' A' ' 59' ' ' LEU . 60.1 tp -77.59 123.95 27.29 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.533 -0.73 . . . . 0.0 109.848 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.55 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.8 m-20 -66.28 90.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.339 -0.851 . . . . 0.0 109.437 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.95 -23.03 11.68 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.053 -1.029 . . . . 0.0 109.174 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.58 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 46.5 t80 -78.91 -58.95 2.98 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.228 -0.92 . . . . 0.0 111.618 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -58.61 -36.46 74.05 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.661 -1.275 . . . . 0.0 109.898 -178.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 54' ' ' LEU . 62.0 tp -62.77 -43.0 99.94 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.444 ' CE2' HG13 ' A' ' 64' ' ' ILE . 60.7 t80 -61.16 -69.94 0.21 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.815 -0.553 . . . . 0.0 109.56 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.818 ' H ' HD22 ' A' ' 61' ' ' ASN . 1.2 m-80 -42.73 -37.24 1.69 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.323 -0.86 . . . . 0.0 109.732 -179.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.506 HD13 ' HA ' ' A' ' 81' ' ' ILE . 9.5 mt -67.33 -51.8 48.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.856 HG21 ' CE2' ' A' ' 102' ' ' TYR . 38.8 t -57.92 -43.99 85.72 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.702 -0.624 . . . . 0.0 109.605 179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.506 HD12 ' OE1' ' A' ' 110' ' ' GLU . 14.2 mm -69.06 -37.88 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -17.55 32.76 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 120.269 -0.573 . . . . 0.0 109.794 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.681 ' HG3' HD13 ' A' ' 77' ' ' LEU . 7.5 mpt_? -97.87 4.35 49.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.838 -1.164 . . . . 0.0 109.361 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.61 12.32 80.36 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.107 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 133.2 138.33 4.03 Favored Glycine 0 N--CA 1.504 3.202 0 O-C-N 120.512 -1.581 . . . . 0.0 111.701 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 102' ' ' TYR . 7.5 tp -50.75 -43.07 58.13 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.766 -0.844 . . . . 0.0 111.349 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.8 t -60.03 -42.16 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 120.73 -1.231 . . . . 0.0 110.062 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -55.43 -37.98 68.38 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.012 -1.055 . . . . 0.0 109.313 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 76' ' ' LYS . 54.5 t -64.3 -43.62 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.584 -0.698 . . . . 0.0 109.936 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.5 mt -66.34 -58.2 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.854 -1.153 . . . . 0.0 110.987 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 88.7 m-20 -57.12 -41.48 79.08 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.034 -1.041 . . . . 0.0 110.344 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -93.06 -10.57 35.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.95 . . . . 0.0 110.608 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.598 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.8 mttp 59.18 60.6 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -0.825 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' A' ' 66' ' ' ARG . 13.7 mt -91.43 13.39 17.69 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.911 -1.118 . . . . 0.0 108.107 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.476 ' CE2' HG12 ' A' ' 72' ' ' VAL . 85.1 m95 -63.05 -41.32 99.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.352 -0.842 . . . . 0.0 109.398 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 99.3 mm-40 -50.62 -36.7 36.52 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 118.054 -1.458 . . . . 0.0 108.112 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.0 mm-40 -71.17 -43.34 67.66 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.506 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.0 mt -67.8 -54.16 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.541 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.3 mt -53.13 -54.58 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -67.79 -40.55 83.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.174 -0.954 . . . . 0.0 109.32 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.38 -32.22 44.5 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.6 mt -89.57 -7.73 54.22 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.469 -1.018 . . . . 0.0 108.631 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 65.12 40.8 4.85 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.308 0.575 . . . . 0.0 110.097 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 30.1 mt -72.47 148.77 90.81 Favored Pre-proline 0 N--CA 1.489 1.477 0 O-C-N 121.219 -0.926 . . . . 0.0 108.955 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.49 164.61 33.62 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.328 2.019 . . . . 0.0 112.129 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.8 m -82.66 -0.03 45.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.0 108.855 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 m -65.49 -33.4 75.83 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.601 -0.687 . . . . 0.0 110.235 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.419 HD13 ' SD ' ' A' ' 49' ' ' MET . 89.3 mt -91.51 100.43 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.672 -1.267 . . . . 0.0 109.312 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 67.1 p -72.24 -23.32 61.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.272 -0.892 . . . . 0.0 109.139 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.0 m -101.55 40.67 1.28 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.492 -0.755 . . . . 0.0 109.156 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -63.08 1.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 108.853 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.541 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.36 -50.91 15.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.539 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.71 -42.47 88.75 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.788 -1.195 . . . . 0.0 109.171 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.618 HG21 ' SD ' ' A' ' 49' ' ' MET . 19.7 m -62.42 -41.17 98.5 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.127 -0.983 . . . . 0.0 108.819 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.455 HD22 HD13 ' A' ' 59' ' ' LEU . 8.5 mt -69.57 -48.35 60.58 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.722 -0.611 . . . . 0.0 109.816 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.711 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -63.35 -51.08 67.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.239 -0.913 . . . . 0.0 110.974 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.5 m -55.64 -55.12 35.8 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.236 -0.915 . . . . 0.0 109.792 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -63.3 -42.02 99.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -0.887 . . . . 0.0 111.477 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.856 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -57.83 -40.94 81.21 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.278 -1.514 . . . . 0.0 109.321 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.587 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -53.01 -56.85 12.98 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.555 -0.715 . . . . 0.0 111.566 -178.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mttm -74.58 -52.65 11.22 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.871 -1.143 . . . . 0.0 113.151 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.25 -47.76 11.19 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 106' ' ' LEU . 11.2 mp -97.11 -3.2 41.61 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.169 -1.582 . . . . 0.0 113.4 -176.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 74.8 t80 -64.14 -35.77 16.72 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 119.981 -1.699 . . . . 0.0 109.876 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 25.7 Cg_exo -63.6 -55.13 0.75 Allowed 'Trans proline' 0 N--CA 1.5 1.888 0 C-N-CA 122.427 2.085 . . . . 0.0 112.545 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.82 -46.14 85.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.42 -0.8 . . . . 0.0 109.212 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . 0.506 ' OE1' HD12 ' A' ' 64' ' ' ILE . 3.4 tp10 -66.25 -53.57 35.33 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.317 -0.864 . . . . 0.0 109.727 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.6 t -67.24 -45.38 76.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 110.353 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -67.26 -48.91 66.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.165 -0.96 . . . . 0.0 111.379 -178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -73.57 -32.45 64.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.107 -0.996 . . . . 0.0 112.246 -177.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HG2' HD21 ' A' ' 116' ' ' LEU . 2.2 tppt? -125.18 -27.54 3.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.888 -1.132 . . . . 0.0 111.854 -177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.59 45.47 24.77 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.742 -1.224 . . . . 0.0 110.528 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.538 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.9 mt -68.05 -28.39 67.34 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.029 -1.044 . . . . 0.0 110.943 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -152.49 -167.01 2.63 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 118.733 -1.187 . . . . 0.0 111.607 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.534 ' N ' ' OG ' ' A' ' 117' ' ' SER . 76.7 p -131.41 158.55 74.98 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.661 -0.649 . . . . 0.0 109.914 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.11 -40.4 86.01 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.671 1.581 . . . . 0.0 112.437 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.77 -38.9 92.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.782 -1.199 . . . . 0.0 109.788 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.417 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.6 mt-10 -65.09 -41.06 95.34 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.587 HD21 ' HG3' ' A' ' 103' ' ' MET . 20.2 tp -69.36 -50.34 47.18 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.684 -0.635 . . . . 0.0 110.219 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -58.35 -46.55 86.03 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.054 -1.028 . . . . 0.0 109.729 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.32 -42.34 98.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.373 -0.829 . . . . 0.0 110.408 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.12 -33.5 74.62 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.087 -1.008 . . . . 0.0 108.429 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.502 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.3 mt -64.67 -49.52 79.95 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.962 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.51 -38.22 86.57 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.78 75.82 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.711 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 29.6 p30 -94.13 -28.25 15.79 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.266 -1.137 . . . . 0.0 110.456 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.1 mtp180 . . . . . 0 N--CA 1.494 1.742 0 O-C-N 120.766 -1.209 . . . . 0.0 109.491 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.908 ' O ' HG12 ' A' ' 13' ' ' VAL . 9.4 mm-40 . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -50.91 -47.44 60.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 0.0 109.535 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -61.36 -42.28 98.45 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.179 -0.951 . . . . 0.0 109.469 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -67.0 -51.53 53.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.179 -0.95 . . . . 0.0 111.194 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.908 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -71.74 -39.61 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.256 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -58.92 -38.9 80.02 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.099 -1.626 . . . . 0.0 108.155 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.495 ' NE2' ' OE1' ' A' ' 18' ' ' GLU . 19.3 mm-40 -60.71 -31.32 70.61 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.648 178.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.547 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.4 mt -64.55 -39.15 93.23 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 110.734 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.412 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -79.57 -34.98 40.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.561 -1.337 . . . . 0.0 109.835 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.495 ' OE1' ' NE2' ' A' ' 15' ' ' GLN . 97.7 mt-10 -64.8 -29.22 70.18 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.063 -1.023 . . . . 0.0 110.601 -178.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.53 HD12 ' HA ' ' A' ' 16' ' ' LEU . 16.5 mt -37.82 -39.94 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.518 -0.739 . . . . 0.0 110.897 -178.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 0.9 OUTLIER -173.02 164.97 4.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.649 -1.282 . . . . 0.0 110.677 -179.159 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -92.14 67.18 4.99 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.838 -0.539 . . . . 0.0 110.078 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.33 102.87 54.14 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.36 -48.83 14.25 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.952 1.768 . . . . 0.0 112.341 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 24' ' ' LYS . 0.9 OUTLIER -61.04 -37.1 81.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.996 -1.065 . . . . 0.0 108.919 179.421 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.642 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.2 ttt-85 -60.33 -42.89 96.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.306 -0.871 . . . . 0.0 109.439 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -62.22 -52.61 63.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.991 -1.068 . . . . 0.0 109.644 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -52.26 -35.04 48.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 0.0 109.288 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.98 -62.69 1.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.639 0.733 . . . . 0.0 110.549 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.547 HD13 ' HB3' ' A' ' 16' ' ' LEU . 14.6 mt -57.38 -43.21 83.42 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.643 -0.661 . . . . 0.0 109.365 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.412 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 96.5 m-20 -58.94 -50.75 72.88 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.211 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -66.99 -44.03 81.44 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.341 -0.85 . . . . 0.0 110.333 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.4 tp -57.96 -50.42 73.44 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.94 . . . . 0.0 110.381 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -60.85 -34.23 74.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.154 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -67.03 -54.66 19.49 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.336 -0.852 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.53 -38.98 86.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.661 -179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mmm -59.47 -39.41 83.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 111.512 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.427 ' NE2' ' HB3' ' A' ' 42' ' ' PRO . 85.2 mm-40 -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.739 -1.225 . . . . 0.0 110.783 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 52.9 mttt -64.96 -44.05 90.66 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.031 -1.043 . . . . 0.0 109.509 -179.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.47 HH11 ' HB3' ' A' ' 108' ' ' PRO . 7.8 mtp180 -63.2 -25.47 68.35 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.963 -177.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.21 0.23 55.91 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 107.977 -2.049 . . . . 0.0 107.977 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 50.1 p -115.61 83.9 11.74 Favored Pre-proline 0 N--CA 1.49 1.56 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 70.7 Cg_endo -85.08 142.73 8.86 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.647 2.232 . . . . 0.0 111.084 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.502 HG21 HD23 ' A' ' 46' ' ' LEU . 45.2 mt -78.88 94.53 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 C-N-CA 118.795 -1.162 . . . . 0.0 109.329 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.593 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 82.1 m-20 -65.97 -32.89 74.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -151.23 133.28 15.16 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.502 HD23 HG21 ' A' ' 43' ' ' ILE . 13.1 mt -71.45 146.76 92.08 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 120.784 -1.197 . . . . 0.0 109.267 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.54 104.16 1.76 Allowed 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 121.636 1.558 . . . . 0.0 109.735 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.2 mt -72.7 142.4 15.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.082 -1.011 . . . . 0.0 110.202 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.815 ' SD ' HG21 ' A' ' 97' ' ' THR . 64.9 mmm -138.51 127.96 24.61 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.782 0.801 . . . . 0.0 108.972 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.522 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 63.32 40.04 8.94 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 -178.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 59.42 22.62 11.1 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.321 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.8 m -137.1 155.4 49.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.182 -0.949 . . . . 0.0 109.512 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 m -65.82 143.4 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.81 -1.181 . . . . 0.0 108.836 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 59' ' ' LEU . 42.1 tp -77.76 124.45 27.97 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.17 -0.956 . . . . 0.0 109.135 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -65.17 91.64 0.1 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.569 -0.707 . . . . 0.0 110.045 -178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.3 mt -53.89 -25.14 18.59 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 120.99 -1.068 . . . . 0.0 108.848 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.48 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 46.9 t80 -79.38 -57.85 3.5 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 111.685 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.13 -39.25 91.92 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.659 -1.276 . . . . 0.0 110.153 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 54' ' ' LEU . 60.7 tp -60.02 -40.98 91.15 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.829 -1.169 . . . . 0.0 108.352 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -61.56 -67.17 0.43 Allowed 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.48 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 88.0 m-20 -43.06 -39.75 2.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.482 -0.761 . . . . 0.0 111.123 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -70.21 -46.58 64.25 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 117.656 -1.618 . . . . 0.0 107.356 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.902 HG21 ' CE2' ' A' ' 102' ' ' TYR . 33.8 t -57.61 -44.49 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 110.566 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.499 HG23 HD11 ' A' ' 116' ' ' LEU . 10.9 mm -70.16 -34.2 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 120.508 -1.37 . . . . 0.0 108.007 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.18 -20.44 26.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.82 -0.55 . . . . 0.0 110.232 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.587 HH21 ' CB ' ' A' ' 80' ' ' GLU . 14.6 mmt-85 -94.53 2.07 55.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.713 -1.242 . . . . 0.0 108.732 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.97 14.4 77.37 Favored Glycine 0 N--CA 1.493 2.438 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.154 177.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.61 2.96 Favored Glycine 0 N--CA 1.501 2.974 0 O-C-N 120.519 -1.577 . . . . 0.0 111.316 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.503 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.7 tp -50.11 -40.91 47.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.65 -0.912 . . . . 0.0 110.754 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.549 HG22 ' HA ' ' A' ' 122' ' ' LEU . 76.3 t -58.99 -41.54 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.903 -1.123 . . . . 0.0 109.863 -179.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -56.4 -39.84 73.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.995 -1.065 . . . . 0.0 108.877 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 76' ' ' LYS . 98.2 t -64.99 -44.26 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.544 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.402 HD12 ' CD1' ' A' ' 122' ' ' LEU . 43.8 mt -67.44 -52.54 40.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.821 0 O-C-N 120.862 -1.149 . . . . 0.0 110.01 -178.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.473 HD21 ' CB ' ' A' ' 125' ' ' ALA . 4.5 m120 -57.73 -42.97 84.95 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.995 -1.066 . . . . 0.0 110.35 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -94.94 -8.88 35.75 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 72' ' ' VAL . 37.7 mtmt 59.04 60.69 2.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.338 -0.851 . . . . 0.0 109.703 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.413 HD13 ' HD2' ' A' ' 66' ' ' ARG . 14.7 mt -90.9 17.63 7.59 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.503 ' CH2' HD11 ' A' ' 69' ' ' LEU . 97.9 m95 -64.48 -43.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.537 179.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 78' ' ' TRP . 50.8 mt-30 -48.21 -38.83 19.31 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.254 -1.379 . . . . 0.0 108.35 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.587 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.0 mm-40 -66.39 -40.79 89.87 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -72.41 -52.32 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.568 HD11 ' HB2' ' A' ' 95' ' ' ALA . 45.9 mt -52.96 -52.55 27.86 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -72.3 -40.7 67.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.479 -0.763 . . . . 0.0 109.899 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.75 -34.87 45.24 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.8 mt -89.71 -7.96 53.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -1.075 . . . . 0.0 108.888 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 67.22 38.5 3.33 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.34 0.591 . . . . 0.0 109.546 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.66 120.08 78.73 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.407 -0.808 . . . . 0.0 108.967 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.481 ' C ' ' H ' ' A' ' 90' ' ' SER . 50.8 Cg_exo -47.79 139.16 19.51 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.767 1.645 . . . . 0.0 112.694 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 83.4 p -60.84 0.91 0.17 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.344 -0.848 . . . . 0.0 109.887 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.481 ' H ' ' C ' ' A' ' 88' ' ' PRO . 6.0 m -62.7 -33.04 74.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.146 -0.971 . . . . 0.0 109.503 -178.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.522 HD11 ' H ' ' A' ' 50' ' ' ALA . 85.7 mt -87.2 101.12 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.826 -1.171 . . . . 0.0 108.937 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 39.1 p -68.18 -29.31 68.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.311 -0.868 . . . . 0.0 109.132 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -94.79 39.96 1.1 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.53 -0.731 . . . . 0.0 109.067 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.77 -64.62 0.86 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.14 -0.975 . . . . 0.0 108.931 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.568 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.98 24.22 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.342 -0.849 . . . . 0.0 109.6 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.519 HD12 ' NH2' ' A' ' 99' ' ' ARG . 6.8 tp -58.61 -47.38 84.52 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.732 -1.23 . . . . 0.0 109.628 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.815 HG21 ' SD ' ' A' ' 49' ' ' MET . 58.1 m -59.51 -40.1 86.02 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.032 -1.043 . . . . 0.0 108.842 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.404 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.6 mt -71.05 -45.45 63.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.659 -0.651 . . . . 0.0 110.255 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.519 ' NH2' HD12 ' A' ' 96' ' ' LEU . 9.1 tmm_? -67.28 -50.67 59.42 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.841 -1.162 . . . . 0.0 110.952 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.3 m -55.99 -54.8 40.52 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.163 -0.961 . . . . 0.0 110.081 -178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -61.99 -40.57 96.07 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.105 -0.997 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.902 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.8 t80 -57.58 -39.82 77.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.21 -1.556 . . . . 0.0 109.402 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . 0.572 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.7 ttm -55.58 -55.94 26.16 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.393 -0.817 . . . . 0.0 112.246 -178.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -72.85 -52.05 16.34 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.627 -1.296 . . . . 0.0 112.823 -176.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.505 ' C ' HD12 ' A' ' 106' ' ' LEU . 58.6 m-85 -83.69 -43.19 15.8 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -175.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -99.63 -7.25 26.0 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.283 -1.511 . . . . 0.0 114.238 -176.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.652 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 46.5 t80 -62.3 -36.92 31.94 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 119.686 -1.884 . . . . 0.0 109.727 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.652 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.9 Cg_exo -65.69 -56.81 0.29 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.242 1.961 . . . . 0.0 112.091 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.31 -35.93 74.7 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -71.8 -56.21 6.17 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.732 -0.605 . . . . 0.0 110.309 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.5 OUTLIER -69.96 -41.53 74.36 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.304 -0.872 . . . . 0.0 110.1 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 45.4 tp10 -66.57 -49.52 66.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.261 -0.9 . . . . 0.0 110.799 -178.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -74.67 -30.22 61.52 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.088 -1.008 . . . . 0.0 111.513 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG2' HD21 ' A' ' 116' ' ' LEU . 40.2 tptt -125.35 -27.63 3.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.004 -1.06 . . . . 0.0 112.115 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' A' ' 111' ' ' CYS . 29.9 t30 57.04 45.42 21.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.579 -1.326 . . . . 0.0 110.065 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.499 HD11 HG23 ' A' ' 64' ' ' ILE . 78.7 mt -67.55 -33.24 74.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.116 -0.99 . . . . 0.0 111.431 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.568 ' OG ' ' N ' ' A' ' 118' ' ' THR . 27.6 t -154.28 -166.11 2.27 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.598 -1.241 . . . . 0.0 111.75 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.568 ' N ' ' OG ' ' A' ' 117' ' ' SER . 81.9 p -124.67 152.24 68.88 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.888 -0.508 . . . . 0.0 109.754 -178.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.66 -38.71 91.08 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.2 1.933 . . . . 0.0 112.326 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.65 88.11 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.874 -1.141 . . . . 0.0 109.427 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -65.78 -42.09 91.2 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 103' ' ' MET . 13.0 tp -67.56 -51.72 47.24 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.686 -0.634 . . . . 0.0 109.871 178.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.12 -45.67 79.44 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.948 -1.095 . . . . 0.0 108.289 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.35 89.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.421 -0.799 . . . . 0.0 109.201 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.473 ' CB ' HD21 ' A' ' 74' ' ' ASN . . . -67.76 -36.63 80.87 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.527 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.9 mt -64.1 -48.72 84.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.424 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 58.1 t0 -62.22 -37.64 86.15 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.957 -1.09 . . . . 0.0 108.256 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.65 -33.27 84.43 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.641 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 28.1 p-10 -92.27 -31.63 15.33 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.9 -1.353 . . . . 0.0 110.424 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.641 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 81.8 mtm180 . . . . . 0 N--CA 1.49 1.544 0 O-C-N 120.613 -1.305 . . . . 0.0 109.418 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -114.74 89.54 3.12 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.421 -1.046 . . . . 0.0 109.338 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.13 137.35 51.57 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.381 -0.824 . . . . 0.0 109.603 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -56.94 -37.87 72.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.406 -0.809 . . . . 0.0 109.997 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.28 -43.93 96.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.996 -1.065 . . . . 0.0 108.744 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -56.96 -39.41 74.52 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.373 -0.83 . . . . 0.0 109.014 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.586 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 19.8 mm-40 -74.0 -34.87 64.34 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.265 -0.897 . . . . 0.0 109.271 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -56.18 -49.38 74.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.952 -1.092 . . . . 0.0 109.83 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.6 mtmm -60.74 -35.63 76.84 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.035 -1.041 . . . . 0.0 108.911 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -66.35 -49.99 65.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.55 -0.719 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.28 -35.86 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 120.771 -1.206 . . . . 0.0 108.901 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.572 ' NH1' ' OE2' ' A' ' 18' ' ' GLU . 0.5 OUTLIER -54.83 -40.47 69.61 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.435 ' HA ' HE21 ' A' ' 15' ' ' GLN . 7.4 mm-40 -59.76 -31.64 69.84 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.493 ' HB3' HD13 ' A' ' 29' ' ' LEU . 13.1 mt -70.77 -37.31 73.35 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.354 -0.841 . . . . 0.0 111.129 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.401 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.3 m-85 -79.25 -33.0 43.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.487 -1.383 . . . . 0.0 110.329 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.572 ' OE2' ' NH1' ' A' ' 14' ' ' ARG . 97.8 mt-10 -66.24 -30.06 70.43 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.915 -1.115 . . . . 0.0 110.45 -178.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.679 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.9 mt -36.17 -40.39 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 O-C-N 121.719 -0.613 . . . . 0.0 110.687 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -171.68 164.6 6.66 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.654 -1.279 . . . . 0.0 110.766 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -90.79 65.6 5.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.748 -0.595 . . . . 0.0 110.103 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.569 ' OD1' ' N ' ' A' ' 25' ' ' ARG . 10.8 t70 -112.42 95.72 32.75 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.351 -0.843 . . . . 0.0 108.847 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.46 -41.72 35.92 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.369 2.046 . . . . 0.0 112.217 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -60.06 -41.0 91.42 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.208 -0.932 . . . . 0.0 108.486 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.679 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.4 ttt180 -61.32 -38.96 88.77 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.631 -0.668 . . . . 0.0 110.134 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -59.88 -48.89 79.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.191 -0.943 . . . . 0.0 109.41 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -53.46 -38.49 63.63 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.51 -0.744 . . . . 0.0 109.367 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -64.55 -61.25 2.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.976 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD13 ' HB3' ' A' ' 16' ' ' LEU . 49.1 mt -55.47 -46.67 76.82 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.334 -0.854 . . . . 0.0 108.781 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -62.0 -49.11 77.36 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.219 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' OD2' ' OH ' ' A' ' 109' ' ' TYR . 53.3 t0 -66.7 -42.44 86.42 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -57.89 -50.37 73.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.103 -0.998 . . . . 0.0 110.192 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 46.6 m-85 -61.19 -35.21 76.54 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 118.064 -1.454 . . . . 0.0 107.54 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.529 ' HG ' ' H ' ' A' ' 35' ' ' PHE . 32.3 p -70.76 -53.62 14.78 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.716 0.77 . . . . 0.0 109.371 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.529 ' H ' ' HG ' ' A' ' 34' ' ' SER . 43.9 t80 -57.4 -44.02 84.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.701 -0.624 . . . . 0.0 110.402 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.3 mmm -56.71 -34.46 67.48 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.365 -0.834 . . . . 0.0 109.408 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.423 ' C ' ' OE1' ' A' ' 37' ' ' GLN . 5.2 tm0? -54.43 -41.68 69.65 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' NZ ' ' CD1' ' A' ' 35' ' ' PHE . 6.6 ttpm? -67.07 -40.09 86.97 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.498 -0.751 . . . . 0.0 109.578 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.403 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.8 mmm180 -64.41 -30.76 71.8 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.811 -0.556 . . . . 0.0 109.913 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.24 0.71 65.23 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.1 p -117.17 85.25 18.46 Favored Pre-proline 0 N--CA 1.488 1.44 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -83.47 145.97 12.03 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.537 2.158 . . . . 0.0 111.281 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 15.7 mt -86.9 104.81 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 120.921 -1.112 . . . . 0.0 110.475 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.606 ' O ' ' NE ' ' A' ' 45' ' ' ARG . 79.5 m-20 -85.34 -10.26 56.58 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.606 ' NE ' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -156.21 117.54 3.86 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.475 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 16' ' ' LEU . 3.2 mt -70.82 138.23 85.44 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 120.463 -1.398 . . . . 0.0 108.949 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -52.76 133.93 52.36 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 N-CA-C 109.391 -1.042 . . . . 0.0 109.391 176.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.555 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 5.8 mt -105.14 149.36 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.967 -1.083 . . . . 0.0 109.775 -179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.64 ' SD ' HD13 ' A' ' 54' ' ' LEU . 22.9 mtt -142.23 120.9 12.59 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.45 41.79 7.22 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 70.9 mttt 60.45 27.13 16.74 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.322 0.582 . . . . 0.0 109.597 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.425 ' O ' HG23 ' A' ' 48' ' ' ILE . 86.6 p -137.33 154.67 50.01 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 109.417 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 m -69.31 147.22 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 109.687 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.64 HD13 ' SD ' ' A' ' 49' ' ' MET . 57.4 tp -84.36 127.89 34.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.345 -0.847 . . . . 0.0 109.539 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.588 ' CG ' HH22 ' A' ' 25' ' ' ARG . 4.6 m-20 -66.31 90.33 0.15 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.377 -0.827 . . . . 0.0 109.575 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.7 mt -55.57 -25.27 37.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.976 -1.078 . . . . 0.0 109.601 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -76.3 -54.64 6.49 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.227 -0.921 . . . . 0.0 111.636 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.31 -37.5 83.47 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.778 -1.201 . . . . 0.0 109.739 -178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 HD22 ' A' ' 98' ' ' LEU . 53.9 tp -58.8 -44.72 90.86 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.983 -1.073 . . . . 0.0 108.278 178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.44 ' CE2' HG13 ' A' ' 64' ' ' ILE . 55.6 t80 -56.73 -68.06 0.25 Allowed 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.73 -0.606 . . . . 0.0 109.848 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -42.7 -39.87 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.371 -0.831 . . . . 0.0 111.415 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.416 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 6.1 mt -71.24 -44.35 65.49 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 118.144 -1.422 . . . . 0.0 107.628 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.794 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.4 t -59.16 -46.11 92.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.282 -0.886 . . . . 0.0 109.848 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.44 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -67.98 -35.83 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.711 -1.243 . . . . 0.0 108.414 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.75 -25.82 20.53 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.985 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.611 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.6 mpt_? -91.3 -2.9 57.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.564 -1.335 . . . . 0.0 109.109 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.31 20.55 56.77 Favored Glycine 0 N--CA 1.492 2.42 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.227 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.97 132.64 3.09 Favored Glycine 0 N--CA 1.5 2.914 0 O-C-N 120.503 -1.586 . . . . 0.0 111.407 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' HH2' ' A' ' 78' ' ' TRP . 9.7 tp -49.85 -38.35 34.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.645 -0.915 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.62 HG22 ' HA ' ' A' ' 122' ' ' LEU . 70.1 t -59.15 -42.79 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 120.912 -1.117 . . . . 0.0 110.814 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -56.34 -39.08 72.25 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.776 -1.203 . . . . 0.0 109.218 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 49.5 t -63.34 -43.59 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.756 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 83.6 mt -66.04 -57.16 11.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 O-C-N 120.834 -1.166 . . . . 0.0 110.284 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' HG12 ' A' ' 70' ' ' VAL . 13.5 m120 -57.1 -42.85 81.54 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.268 -0.895 . . . . 0.0 110.28 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -94.44 -7.31 41.82 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.924 . . . . 0.0 111.292 -179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.6 mttm 58.8 58.33 3.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.299 -0.876 . . . . 0.0 110.589 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.0 mt -91.81 13.82 17.23 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.779 -1.2 . . . . 0.0 108.51 178.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.562 ' HH2' HD11 ' A' ' 69' ' ' LEU . 84.0 m95 -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.372 -0.83 . . . . 0.0 108.777 178.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.55 ' NE2' ' OP1' ' C' ' 419' ' ' ' DC' . 9.4 mp0 -50.15 -40.18 45.68 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 120.618 -1.302 . . . . 0.0 108.342 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.611 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.3 mt-10 -68.51 -40.59 80.77 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.083 -1.011 . . . . 0.0 108.302 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.35 -52.15 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 67.4 mt -53.07 -53.61 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.519 -0.738 . . . . 0.0 109.354 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 86' ' ' HIS . 26.1 mmtp -72.01 -39.59 69.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.257 -0.902 . . . . 0.0 109.888 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.63 -31.57 22.82 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.63 -6.83 51.57 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.439 -1.036 . . . . 0.0 109.127 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 83' ' ' LYS . 41.9 m-70 65.86 41.12 3.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.776 -0.578 . . . . 0.0 109.921 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' CD2' ' SD ' ' A' ' 49' ' ' MET . 12.0 mt -73.02 147.78 88.62 Favored Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.405 -0.81 . . . . 0.0 109.339 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.417 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.9 Cg_endo -73.29 141.47 32.17 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 C-N-CA 122.353 2.035 . . . . 0.0 112.368 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.7 p -62.25 -0.78 0.6 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.833 . . . . 0.0 109.987 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.417 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.0 p -65.79 -23.51 66.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.09 -1.006 . . . . 0.0 109.934 -178.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 80.2 mt -98.3 105.96 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 120.96 -1.088 . . . . 0.0 109.224 178.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 50.6 p -76.19 -25.66 55.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 109.054 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.1 m -96.05 34.64 1.53 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.546 -0.721 . . . . 0.0 109.259 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.29 -64.43 0.95 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.68 25.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.315 -0.865 . . . . 0.0 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.416 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 6.0 tp -58.88 -43.15 90.84 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.801 -1.187 . . . . 0.0 108.954 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.7 m -60.11 -40.14 88.63 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.085 -1.009 . . . . 0.0 108.426 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -70.55 -46.54 63.37 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.664 -0.647 . . . . 0.0 109.675 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.584 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.6 ttm180 -66.32 -52.09 50.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.905 -1.122 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.485 HG22 ' HE2' ' A' ' 104' ' ' LYS . 50.2 m -55.69 -54.09 48.53 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.133 -0.979 . . . . 0.0 110.228 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.555 ' OE1' ' CD2' ' A' ' 54' ' ' LEU . 1.0 OUTLIER -65.67 -43.68 88.57 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 120.975 -1.078 . . . . 0.0 112.012 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.794 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.5 t80 -55.68 -41.72 74.14 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.06 -1.65 . . . . 0.0 108.893 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.742 ' HG2' HD21 ' A' ' 122' ' ' LEU . 90.7 mtp -53.14 -50.72 63.96 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.514 -0.741 . . . . 0.0 110.621 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.485 ' HE2' HG22 ' A' ' 100' ' ' THR . 32.1 mttm -72.37 -53.95 10.82 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.031 -1.043 . . . . 0.0 112.875 -177.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.412 ' C ' HD12 ' A' ' 106' ' ' LEU . 27.9 m-85 -85.51 -52.63 5.71 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.1 mp -94.53 2.82 55.68 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.303 -1.498 . . . . 0.0 113.796 -175.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.635 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.1 t80 -62.98 -35.96 21.89 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 120.048 -1.657 . . . . 0.0 110.405 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.635 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 12.3 Cg_exo -68.53 -54.21 0.3 Allowed 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.13 1.887 . . . . 0.0 112.31 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.408 ' OH ' ' OD2' ' A' ' 31' ' ' ASP . 0.8 OUTLIER -56.97 -47.61 80.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.391 -0.818 . . . . 0.0 109.299 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 87.2 tt0 -68.89 -44.83 72.43 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.169 -0.957 . . . . 0.0 110.562 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.3 t -81.04 -45.97 15.74 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.977 -1.077 . . . . 0.0 111.244 -178.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 108' ' ' PRO . 44.1 tp10 -67.76 -51.7 45.9 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.634 -1.291 . . . . 0.0 111.518 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -73.72 -33.14 64.23 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.855 -1.153 . . . . 0.0 111.797 -178.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HG2' HD21 ' A' ' 116' ' ' LEU . 34.1 tptt -114.55 -29.48 6.82 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.833 -1.167 . . . . 0.0 111.784 -177.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 111' ' ' CYS . 53.5 t30 57.29 44.79 21.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.6 -1.313 . . . . 0.0 110.288 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.444 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.8 mt -66.08 -30.06 70.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.223 -0.923 . . . . 0.0 110.581 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -154.47 -167.25 2.56 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 119.061 -1.056 . . . . 0.0 110.917 -178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' A' ' 117' ' ' SER . 82.1 p -129.01 159.49 68.47 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.515 -0.741 . . . . 0.0 109.672 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -55.52 -40.29 86.3 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.595 1.53 . . . . 0.0 112.207 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.29 -37.59 87.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.015 -1.053 . . . . 0.0 109.379 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.424 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.28 -46.06 74.75 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 178.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 103' ' ' MET . 17.6 tp -65.61 -53.28 43.85 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.404 -0.81 . . . . 0.0 109.942 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -56.86 -44.49 82.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.013 -1.054 . . . . 0.0 108.907 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.05 85.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.114 -0.991 . . . . 0.0 109.155 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.439 ' CB ' HD21 ' A' ' 74' ' ' ASN . . . -68.28 -35.97 78.67 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.742 HD11 ' SD ' ' A' ' 103' ' ' MET . 29.4 mt -64.09 -49.82 79.72 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -61.14 -38.46 86.48 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.88 88.67 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 110.156 -1.177 . . . . 0.0 110.156 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.663 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.2 OUTLIER -94.05 -31.68 14.12 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.073 -1.251 . . . . 0.0 110.078 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.656 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.2 mtp180 -63.91 145.48 55.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.853 -1.154 . . . . 0.0 109.607 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.572 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -63.83 140.1 58.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.389 -0.82 . . . . 0.0 109.292 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -66.52 -19.95 65.91 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.162 -0.961 . . . . 0.0 109.444 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.724 0 O4'-C1'-C2' 108.31 2.009 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.262 0 O4'-C4'-C3' 107.853 2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.871 0 O4'-C4'-C3' 107.625 2.025 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.119 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.917 0 O5'-C5'-C4' 113.052 2.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.796 0 O5'-C5'-C4' 112.976 1.983 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.636 0 O5'-C5'-C4' 113.221 2.158 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.555 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.143 0 O4'-C4'-C3' 107.754 2.154 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.906 0 O5'-C5'-C4' 113.283 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.413 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.248 0 O4'-C1'-C2' 108.566 2.242 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.413 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.85 0 O5'-C5'-C4' 113.205 2.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.078 0 O5'-C5'-C4' 113.439 2.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.055 0 O4'-C4'-C3' 107.797 2.197 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.777 0 O4'-C4'-C3' 107.561 1.961 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O4'-C4'-C3' 108.004 2.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.823 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.939 0 O4'-C1'-C2' 109.038 2.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.362 0 C4'-C3'-C2' 105.696 2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.493 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 1.972 0 O5'-C5'-C4' 112.8 1.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.55 ' OP1' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.523 1.542 0 O5'-C5'-C4' 113.653 2.466 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.558 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.844 0 O4'-C4'-C3' 107.958 2.358 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.416 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O4'-C4'-C3' 107.782 2.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O5'-C5'-C4' 113.468 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.802 0 O5'-C5'-C4' 113.671 2.48 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C1'-C2' 108.839 2.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.234 0 O4'-C4'-C3' 108.035 2.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.322 0 O4'-C4'-C3' 107.585 1.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.498 0 O4'-C4'-C3' 107.729 2.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.894 0 O5'-C5'-C4' 112.933 1.952 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C4'-C3' 107.751 2.151 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.162 0 C1'-O4'-C4' 106.174 -2.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.594 ' CZ2' ' ND2' ' A' ' 44' ' ' ASN . 32.0 p90 -96.38 108.78 21.36 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.369 -1.077 . . . . 0.0 109.524 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.2 p -62.62 158.93 17.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.173 -0.955 . . . . 0.0 110.109 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -58.61 -28.9 66.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.614 -0.678 . . . . 0.0 109.873 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.61 -47.98 82.97 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.05 -1.031 . . . . 0.0 109.074 -179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -49.79 -40.45 41.64 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.595 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 2.3 mp0 -74.25 -36.79 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.482 -0.761 . . . . 0.0 109.009 178.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -48.51 -52.58 21.77 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.882 . . . . 0.0 109.81 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 mtmm -61.22 -39.92 92.07 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.2 -0.938 . . . . 0.0 108.9 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.414 ' C ' HD11 ' A' ' 46' ' ' LEU . 14.3 mm100 -66.52 -49.18 67.38 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.365 -0.834 . . . . 0.0 110.798 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -70.96 -37.79 69.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 120.497 -1.377 . . . . 0.0 108.789 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -53.3 -39.21 63.83 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.592 -1.317 . . . . 0.0 107.761 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -58.93 -31.47 68.71 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.458 ' CD1' HD22 ' A' ' 46' ' ' LEU . 8.3 mt -72.48 -38.75 68.11 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.281 -0.887 . . . . 0.0 111.504 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -76.49 -33.24 58.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.433 -1.417 . . . . 0.0 110.314 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.479 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.5 mm-40 -66.98 -26.63 66.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.967 -1.083 . . . . 0.0 110.55 -178.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.697 HG21 HH12 ' A' ' 25' ' ' ARG . 32.2 mt -37.56 -38.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 O-C-N 121.798 -0.564 . . . . 0.0 110.487 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -170.72 161.62 7.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.858 -1.151 . . . . 0.0 110.323 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.7 p30 -88.99 66.52 7.88 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.539 0.685 . . . . 0.0 109.342 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -112.04 93.56 21.93 Favored Pre-proline 0 N--CA 1.489 1.503 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -47.1 -37.98 23.92 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.238 1.958 . . . . 0.0 112.004 -178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -62.77 -40.17 96.47 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.241 -0.912 . . . . 0.0 108.829 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.697 HH12 HG21 ' A' ' 19' ' ' ILE . 62.6 ttt180 -61.35 -37.08 82.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.478 -0.763 . . . . 0.0 110.454 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -60.16 -50.71 72.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.131 -0.981 . . . . 0.0 109.428 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.0 tp10 -53.25 -38.77 63.32 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.431 -0.793 . . . . 0.0 109.677 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -62.01 -62.91 1.45 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.369 -0.832 . . . . 0.0 110.803 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 49.9 mt -55.57 -44.16 76.61 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.448 -0.782 . . . . 0.0 109.414 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.99 -48.57 81.22 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.185 179.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -66.68 -42.73 86.04 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.132 -0.98 . . . . 0.0 109.546 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.48 -53.19 60.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.29 -0.881 . . . . 0.0 110.333 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -62.3 -33.25 74.31 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 118.483 -1.287 . . . . 0.0 107.811 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -67.92 -56.59 8.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.617 -0.677 . . . . 0.0 109.663 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 49.4 t80 -60.78 -42.28 97.22 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.253 -0.904 . . . . 0.0 110.3 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.483 ' CE ' ' O ' ' A' ' 41' ' ' THR . 73.7 mmm -59.17 -40.54 85.92 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.534 -0.729 . . . . 0.0 110.912 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -60.44 -41.57 94.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.954 -1.092 . . . . 0.0 109.72 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.3 ttpm? -61.9 -47.44 84.95 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.576 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.458 HH11 ' HB3' ' A' ' 108' ' ' PRO . 13.2 mtp180 -64.38 -20.93 66.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.105 -0.997 . . . . 0.0 111.282 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.35 3.01 58.82 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.723 -1.751 . . . . 0.0 108.723 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.483 ' O ' ' CE ' ' A' ' 36' ' ' MET . 34.3 p -117.6 83.67 17.82 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.46 -1.024 . . . . 0.0 108.874 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -91.57 139.84 2.39 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 123.054 2.503 . . . . 0.0 112.146 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 78.3 mt -73.46 99.0 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.02 -1.05 . . . . 0.0 109.026 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 94.2 m-20 -64.82 -45.48 86.02 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -133.99 132.58 40.29 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' CD1' ' A' ' 16' ' ' LEU . 2.0 mt -70.97 142.66 88.02 Favored Pre-proline 0 C--N 1.299 -1.607 0 C-N-CA 118.845 -1.142 . . . . 0.0 108.702 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -66.69 134.02 33.76 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.221 1.281 . . . . 0.0 109.095 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.5 mt -100.15 145.71 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.884 -1.135 . . . . 0.0 110.068 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.719 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.7 mtp -141.56 118.84 11.42 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.43 43.13 1.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm 57.35 22.48 7.87 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.752 -0.593 . . . . 0.0 109.649 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.1 m -136.4 152.93 51.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 109.416 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 9.3 m -68.03 147.69 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 109.11 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.719 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.1 tp -79.45 123.17 27.28 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.412 -0.805 . . . . 0.0 110.369 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.529 ' CG ' HH22 ' A' ' 25' ' ' ARG . 12.1 m-20 -63.05 92.38 0.05 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.52 -0.738 . . . . 0.0 109.495 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.53 -27.57 57.83 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.989 -1.069 . . . . 0.0 109.718 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -78.21 -59.97 2.56 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.067 -1.021 . . . . 0.0 111.615 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -58.59 -36.33 73.83 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.743 -1.223 . . . . 0.0 109.871 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.549 HD22 HD21 ' A' ' 54' ' ' LEU . 28.7 tp -62.93 -42.86 99.94 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.442 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.2 t80 -62.83 -68.08 0.37 Allowed 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.436 ' C ' ' O ' ' A' ' 60' ' ' TYR . 61.8 t30 -42.78 -34.67 0.97 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.469 -0.769 . . . . 0.0 109.35 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.883 HD22 HH22 ' A' ' 66' ' ' ARG . 13.6 mt -71.66 -50.89 26.33 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.844 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.6 t -56.6 -43.14 77.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.494 -0.754 . . . . 0.0 110.067 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.442 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.6 mm -69.68 -34.73 62.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.69 -1.256 . . . . 0.0 108.027 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.409 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.51 -20.11 29.21 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.146 -178.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.883 HH22 HD22 ' A' ' 62' ' ' LEU . 15.6 mmt-85 -95.13 -1.34 52.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.644 -1.285 . . . . 0.0 108.438 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.85 16.46 72.66 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.238 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 140.98 130.31 2.59 Favored Glycine 0 N--CA 1.502 3.049 0 CA-C-N 119.569 1.685 . . . . 0.0 111.618 178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.646 HD11 ' CH2' ' A' ' 78' ' ' TRP . 13.1 tp -50.95 -41.83 59.34 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.631 -0.923 . . . . 0.0 110.465 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.0 t -57.86 -43.05 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.952 -1.092 . . . . 0.0 109.25 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -55.95 -37.5 69.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.111 -0.993 . . . . 0.0 108.656 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.1 t -66.73 -43.99 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.632 -0.667 . . . . 0.0 109.975 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.15 -57.58 9.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.759 -1.213 . . . . 0.0 110.124 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.518 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 70.7 m-20 -58.02 -42.08 84.52 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.246 -0.909 . . . . 0.0 110.354 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.61 -9.02 39.44 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.279 -0.888 . . . . 0.0 110.692 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.626 ' N ' ' O ' ' A' ' 72' ' ' VAL . 25.1 mtmt 58.46 57.62 3.76 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.462 -0.773 . . . . 0.0 110.265 -178.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.9 mt -91.37 12.63 19.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.951 -1.093 . . . . 0.0 108.594 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.646 ' CH2' HD11 ' A' ' 69' ' ' LEU . 87.6 m95 -61.11 -40.81 95.18 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 75.5 mt-30 -48.44 -40.93 27.9 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 120.898 -1.126 . . . . 0.0 108.749 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.708 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -66.61 -38.9 87.94 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.424 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.1 mt -72.9 -52.71 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.645 HD11 ' HB2' ' A' ' 95' ' ' ALA . 63.7 mt -54.15 -56.19 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.578 -0.701 . . . . 0.0 109.491 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 86' ' ' HIS . 44.9 mttp -66.68 -41.14 88.57 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.095 -1.003 . . . . 0.0 109.631 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.82 -30.67 29.58 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 20.3 mt -90.47 -8.78 49.59 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.428 -1.042 . . . . 0.0 109.099 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 83' ' ' LYS . 37.1 m-70 63.78 42.41 6.19 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.591 -0.693 . . . . 0.0 109.868 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 mt -72.72 139.41 80.52 Favored Pre-proline 0 C--N 1.304 -1.405 0 O-C-N 121.242 -0.911 . . . . 0.0 108.583 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 40.0 Cg_endo -69.93 142.95 48.56 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 121.915 1.743 . . . . 0.0 112.213 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.9 t -55.94 0.61 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.259 -0.901 . . . . 0.0 109.814 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 93.2 p -66.84 -26.0 66.7 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.222 -0.924 . . . . 0.0 110.193 -178.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.541 HD11 ' H ' ' A' ' 50' ' ' ALA . 87.4 mt -101.47 107.41 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 120.92 -1.112 . . . . 0.0 109.522 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.9 p -79.05 -25.32 43.17 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.251 -0.905 . . . . 0.0 109.027 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -95.33 35.02 1.35 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.561 -0.712 . . . . 0.0 109.445 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.61 -65.2 0.73 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.138 -0.976 . . . . 0.0 108.631 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.645 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.17 -52.98 18.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.302 -0.874 . . . . 0.0 109.21 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.463 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 9.0 tp -58.95 -43.97 91.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.992 -1.067 . . . . 0.0 109.182 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.1 m -61.71 -39.96 93.36 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.953 -1.092 . . . . 0.0 108.692 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.503 HD22 HD13 ' A' ' 59' ' ' LEU . 12.0 mt -67.77 -44.22 77.96 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.562 -0.711 . . . . 0.0 110.068 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.814 ' NH1' HD21 ' A' ' 129' ' ' ASN . 28.6 ttm180 -68.81 -49.96 54.18 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.287 -0.883 . . . . 0.0 111.178 -179.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -52.94 -53.18 53.27 Favored 'General case' 0 C--N 1.294 -1.837 0 C-N-CA 118.717 -1.193 . . . . 0.0 109.115 -178.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -63.83 -42.41 97.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.153 -0.967 . . . . 0.0 111.745 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.844 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.4 t80 -58.96 -43.91 91.38 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.207 -1.558 . . . . 0.0 109.395 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.75 ' HG2' HD21 ' A' ' 122' ' ' LEU . 89.7 mtp -51.52 -56.84 11.16 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.505 -0.747 . . . . 0.0 111.372 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -72.78 -52.67 14.06 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.767 -1.208 . . . . 0.0 112.701 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -85.14 -50.37 7.47 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -174.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 5.4 mp -96.58 -5.02 40.13 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.126 -1.609 . . . . 0.0 114.109 -175.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.9 t80 -60.12 -38.56 60.51 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 119.687 -1.883 . . . . 0.0 109.62 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.7 Cg_exo -65.64 -54.79 0.52 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.421 2.081 . . . . 0.0 112.6 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.78 -39.55 81.4 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.367 -0.833 . . . . 0.0 109.137 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.401 ' OE1' ' N ' ' A' ' 111' ' ' CYS . 0.4 OUTLIER -73.12 -51.16 18.99 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.455 -0.778 . . . . 0.0 110.287 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -71.42 -43.02 67.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.403 -0.81 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -66.93 -51.09 59.51 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.863 -1.148 . . . . 0.0 111.033 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -74.71 -27.88 60.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.146 -0.971 . . . . 0.0 111.691 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG2' HD21 ' A' ' 116' ' ' LEU . 30.7 tptt -123.26 -30.31 3.72 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.911 -1.118 . . . . 0.0 111.298 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.505 ' N ' ' O ' ' A' ' 111' ' ' CYS . 40.0 t30 57.41 45.95 19.01 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 120.819 -1.176 . . . . 0.0 110.12 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 114' ' ' LYS . 60.1 mt -67.03 -31.72 72.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.174 -0.954 . . . . 0.0 110.894 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.2 t -154.39 -166.97 2.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.94 -1.1 . . . . 0.0 111.316 -178.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.508 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.0 p -127.79 158.46 70.27 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.646 -0.659 . . . . 0.0 109.98 -178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -55.87 -41.32 78.43 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 121.651 1.567 . . . . 0.0 112.256 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.31 90.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.849 -1.157 . . . . 0.0 109.668 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.07 -42.4 89.47 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 103' ' ' MET . 27.9 tp -68.49 -52.71 29.31 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.71 -0.619 . . . . 0.0 110.173 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -58.26 -46.41 86.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.382 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.48 -42.23 98.47 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -0.854 . . . . 0.0 110.162 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.518 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -67.72 -33.62 75.24 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.599 HD11 ' SD ' ' A' ' 103' ' ' MET . 11.1 mt -65.9 -46.49 88.35 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.409 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 61.7 t0 -64.73 -37.76 88.68 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.982 -1.074 . . . . 0.0 109.391 179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.37 -29.86 75.61 Favored Glycine 0 N--CA 1.492 2.397 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.033 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.814 HD21 ' NH1' ' A' ' 99' ' ' ARG . 33.9 p-10 -92.0 -31.43 15.6 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.863 -1.374 . . . . 0.0 111.424 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.651 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 76.3 mtm180 -62.51 146.74 50.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.516 -1.365 . . . . 0.0 110.237 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.617 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -62.59 147.58 48.76 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.617 -0.677 . . . . 0.0 109.672 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -64.8 -17.76 64.5 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.201 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.854 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.434 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.846 0 O4'-C1'-C2' 108.0 1.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.51 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.126 0 O4'-C1'-C2' 108.585 2.259 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.991 0 O4'-C4'-C3' 107.483 1.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.336 0 O5'-C5'-C4' 113.368 2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O5'-C5'-C4' 112.884 1.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.523 0 O5'-C5'-C4' 113.254 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.052 0 O5'-C5'-C4' 113.115 2.082 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.534 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.26 0 O4'-C1'-C2' 108.453 2.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.071 0 O5'-C5'-C4' 113.147 2.105 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.41 0 O4'-C1'-C2' 108.583 2.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.77 0 O4'-C4'-C3' 107.648 2.048 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.876 0 O4'-C4'-C3' 107.946 2.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.89 0 O4'-C4'-C3' 107.849 2.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.886 0 O4'-C4'-C3' 107.501 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.159 0 O4'-C4'-C3' 107.999 2.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.461 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.42 -2.333 0 O4'-C1'-C2' 107.717 1.47 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.461 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O4'-C4'-C3' 107.895 2.295 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O5'-C5'-C4' 112.519 1.656 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.609 1.57 0 O5'-C5'-C4' 113.739 2.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.633 0 O4'-C4'-C3' 107.934 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.6 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.779 0 O5'-C5'-C4' 112.834 1.882 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.6 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.021 0 O5'-C5'-C4' 113.638 2.456 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.996 0 O5'-C5'-C4' 113.54 2.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.929 0 O4'-C1'-C2' 108.858 2.508 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.25 0 O4'-C4'-C3' 108.053 2.453 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O4'-C4'-C3' 107.658 2.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.47 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.766 0 O4'-C4'-C3' 107.633 2.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O5'-C5'-C4' 112.996 1.997 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.056 0 O4'-C4'-C3' 107.501 1.901 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.2 t90 -114.21 84.56 2.07 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.367 -1.078 . . . . 0.0 109.238 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -112.04 139.65 47.38 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.383 -0.823 . . . . 0.0 109.261 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -54.96 -37.22 66.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -0.902 . . . . 0.0 109.946 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.02 -42.2 98.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.966 -1.084 . . . . 0.0 109.504 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -58.33 -34.31 70.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.395 -0.815 . . . . 0.0 109.829 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.771 ' O ' HG12 ' A' ' 13' ' ' VAL . 36.0 mm-40 -70.6 -54.28 12.66 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.228 -0.92 . . . . 0.0 110.849 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -49.2 -46.67 45.96 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.724 -1.235 . . . . 0.0 109.252 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -61.18 -40.73 95.01 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.43 -0.794 . . . . 0.0 109.532 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.49 -53.17 25.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.323 -0.861 . . . . 0.0 111.404 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -68.87 -36.14 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 120.803 -1.186 . . . . 0.0 109.279 -179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -58.74 -38.44 78.39 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.301 -1.499 . . . . 0.0 108.03 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 10.0 mm-40 -59.41 -31.71 69.51 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.218 -0.926 . . . . 0.0 108.655 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.494 ' HB3' HD13 ' A' ' 29' ' ' LEU . 7.0 mt -67.09 -40.37 86.96 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.31 -0.869 . . . . 0.0 111.166 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.457 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 83.3 m-85 -74.9 -35.59 62.24 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.487 -1.383 . . . . 0.0 109.595 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.483 ' O ' ' C ' ' A' ' 19' ' ' ILE . 99.1 mt-10 -64.43 -29.9 70.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.627 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.508 HD13 ' NH2' ' A' ' 25' ' ' ARG . 24.2 mt -37.4 -41.21 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.607 -0.683 . . . . 0.0 110.702 -178.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -171.56 163.33 6.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.716 -1.24 . . . . 0.0 110.891 -178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -90.3 69.91 7.08 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 121.462 0.649 . . . . 0.0 109.596 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.01 94.93 27.24 Favored Pre-proline 0 N--CA 1.489 1.523 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -46.69 -44.44 21.7 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 C-N-CA 122.166 1.911 . . . . 0.0 112.024 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -63.43 -40.37 96.97 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.179 -0.95 . . . . 0.0 108.615 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.508 ' NH2' HD13 ' A' ' 19' ' ' ILE . 67.3 ttt180 -61.01 -38.48 86.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.433 -0.792 . . . . 0.0 109.803 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.0 -49.04 79.24 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.16 -0.963 . . . . 0.0 108.686 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -53.61 -38.25 63.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.463 -0.773 . . . . 0.0 109.385 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -64.03 -59.84 3.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.465 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 16' ' ' LEU . 28.4 mt -56.45 -45.54 80.77 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.124 -0.985 . . . . 0.0 108.657 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.457 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 40.8 m-20 -60.15 -47.95 83.79 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.567 -0.853 . . . . 0.0 108.843 179.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -66.41 -43.49 85.6 Favored 'General case' 0 N--CA 1.486 1.355 0 O-C-N 121.484 -0.76 . . . . 0.0 109.889 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 47.8 tp -58.64 -49.75 76.37 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.211 -0.931 . . . . 0.0 110.306 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.6 ' CE1' HD12 ' A' ' 43' ' ' ILE . 49.4 m-85 -59.92 -36.93 78.07 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.953 -1.499 . . . . 0.0 107.792 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.4 m -69.71 -49.86 49.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.363 -0.836 . . . . 0.0 109.813 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.411 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 72.9 t80 -59.12 -46.21 88.92 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.302 -0.874 . . . . 0.0 111.123 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.401 ' SD ' HD11 ' A' ' 43' ' ' ILE . 95.4 mtp -57.36 -34.76 69.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.75 -178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -55.6 -34.99 65.35 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.647 -1.283 . . . . 0.0 108.784 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -74.75 -34.71 62.57 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 25.3 mmm180 -66.25 -30.97 71.51 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.028 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.23 0.17 63.5 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.94 -2.064 . . . . 0.0 107.94 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.0 p -115.25 85.18 12.39 Favored Pre-proline 0 N--CA 1.486 1.35 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.94 140.56 14.42 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 121.94 1.76 . . . . 0.0 110.513 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.6 HD12 ' CE1' ' A' ' 33' ' ' PHE . 29.8 mt -70.47 92.03 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 120.936 -1.103 . . . . 0.0 110.591 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 21.7 m120 -58.9 -30.1 67.54 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -167.17 140.08 3.49 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.573 HD23 HG21 ' A' ' 43' ' ' ILE . 17.1 mt -70.69 144.13 90.65 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 120.857 -1.152 . . . . 0.0 110.237 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.41 134.22 18.6 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.516 1.477 . . . . 0.0 108.369 176.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.6 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 56.6 mt -103.18 142.51 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 110.842 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.568 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.2 mtp -136.24 123.95 22.44 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.04 39.97 4.2 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt 57.57 22.39 8.12 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.273 0.558 . . . . 0.0 110.119 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.45 ' N ' HG23 ' A' ' 48' ' ' ILE . 49.3 m -134.38 151.16 51.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.257 -0.902 . . . . 0.0 109.22 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.56 143.46 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 120.774 -1.204 . . . . 0.0 108.708 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.546 HD21 HD22 ' A' ' 59' ' ' LEU . 64.3 tp -74.58 123.02 24.04 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.258 -0.901 . . . . 0.0 109.468 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -56.41 105.28 0.19 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.562 -0.711 . . . . 0.0 109.315 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.72 -30.57 71.58 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -80.21 -64.96 1.07 Allowed 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.238 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -52.95 -39.82 63.2 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 120.623 -1.298 . . . . 0.0 108.755 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.546 HD22 HD21 ' A' ' 54' ' ' LEU . 24.1 tp -55.8 -48.7 74.92 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.2 t80 -62.75 -66.8 0.49 Allowed 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.442 0.639 . . . . 0.0 109.913 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -43.06 -40.51 3.16 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.459 -0.776 . . . . 0.0 110.905 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.432 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -72.66 -47.07 50.52 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 117.897 -1.521 . . . . 0.0 107.836 179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.785 HG21 ' CE2' ' A' ' 102' ' ' TYR . 26.6 t -55.34 -42.65 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.173 -0.954 . . . . 0.0 109.987 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.409 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.0 mm -68.41 -35.67 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 120.504 -1.372 . . . . 0.0 107.715 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.85 -17.39 23.42 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.961 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.673 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.9 mmt-85 -96.99 5.3 50.7 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.524 -1.36 . . . . 0.0 108.986 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.6 11.24 82.14 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.646 178.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.99 134.56 3.29 Favored Glycine 0 N--CA 1.5 2.95 0 CA-C-N 119.252 1.526 . . . . 0.0 111.413 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 tp -48.55 -42.67 34.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.708 -0.877 . . . . 0.0 110.832 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.507 HG22 ' HA ' ' A' ' 122' ' ' LEU . 95.1 t -58.11 -40.64 78.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.879 -1.138 . . . . 0.0 110.005 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -58.59 -40.36 82.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.002 . . . . 0.0 110.034 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.581 ' O ' ' N ' ' A' ' 76' ' ' LYS . 40.3 t -64.55 -47.01 90.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.264 -0.897 . . . . 0.0 110.639 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.08 -56.68 16.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.814 -1.179 . . . . 0.0 109.894 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.653 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 86.7 m-20 -59.56 -43.69 93.49 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.284 -0.885 . . . . 0.0 111.568 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -94.05 -4.46 49.41 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.909 -1.119 . . . . 0.0 110.685 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.581 ' N ' ' O ' ' A' ' 72' ' ' VAL . 51.0 mttm 59.24 56.74 3.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.595 -0.691 . . . . 0.0 111.135 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.6 mt -90.51 13.84 14.7 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 118.561 -1.256 . . . . 0.0 107.941 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.521 ' O ' ' N ' ' A' ' 82' ' ' ILE . 96.9 m95 -63.49 -41.41 98.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.43 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.9 mt-30 -47.86 -39.92 19.98 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 120.809 -1.182 . . . . 0.0 108.011 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.673 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.3 mt-10 -67.33 -38.54 85.07 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.463 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.0 mt -74.78 -51.91 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.37 -0.831 . . . . 0.0 108.987 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.654 HD11 ' HB2' ' A' ' 95' ' ' ALA . 60.8 mt -50.58 -51.47 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -74.65 -37.4 62.76 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.592 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.44 -32.92 46.18 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 83.2 mt -91.17 -7.31 51.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.38 -1.071 . . . . 0.0 109.255 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 48.3 m-70 65.03 40.59 5.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.777 -0.577 . . . . 0.0 110.106 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.3 mt -72.5 136.83 80.82 Favored Pre-proline 0 N--CA 1.488 1.467 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 35.7 Cg_endo -68.54 144.23 60.06 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.891 1.727 . . . . 0.0 112.48 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.0 p -58.19 0.66 0.06 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.265 -0.897 . . . . 0.0 109.654 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 18.0 m -64.07 -35.31 80.32 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.138 -0.976 . . . . 0.0 109.301 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.594 HD11 ' H ' ' A' ' 50' ' ' ALA . 89.5 mt -90.07 97.41 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.939 -1.101 . . . . 0.0 108.54 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 68.7 p -66.62 -27.86 68.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.873 . . . . 0.0 109.813 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.8 m -102.46 47.77 0.88 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.169 -0.957 . . . . 0.0 109.512 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.71 -59.43 3.58 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.169 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.654 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.83 -51.14 23.91 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.287 -0.883 . . . . 0.0 109.879 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.474 HD12 HH21 ' A' ' 99' ' ' ARG . 5.6 tp -58.4 -44.29 88.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.748 -1.22 . . . . 0.0 109.039 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.3 m -60.81 -40.46 92.78 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.152 -0.968 . . . . 0.0 108.694 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.433 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 10.5 mt -71.18 -44.28 65.76 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.483 -0.761 . . . . 0.0 109.941 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.798 HH12 HD21 ' A' ' 129' ' ' ASN . 40.9 ttp180 -66.5 -53.1 38.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.24 -0.912 . . . . 0.0 110.947 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -56.59 -52.28 65.42 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.473 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -62.46 -40.08 95.46 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.046 -1.034 . . . . 0.0 110.978 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.785 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.7 t80 -57.08 -41.0 78.02 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.382 -1.449 . . . . 0.0 109.2 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.571 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -54.65 -54.72 37.89 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.463 -0.773 . . . . 0.0 111.396 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.8 mttt -72.65 -50.54 24.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.564 -1.335 . . . . 0.0 113.098 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.463 ' C ' HD12 ' A' ' 106' ' ' LEU . 34.3 m-85 -84.8 -52.86 5.74 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -174.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.662 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.0 mp -100.44 12.65 36.76 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.222 -1.549 . . . . 0.0 114.391 -175.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.525 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 62.7 t80 -67.37 -38.65 16.6 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 119.796 -1.815 . . . . 0.0 111.815 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.1 Cg_endo -78.05 -40.09 0.41 Allowed 'Trans proline' 0 N--CA 1.49 1.302 0 C-N-CA 121.475 1.45 . . . . 0.0 112.834 -178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.14 -42.97 87.04 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -68.96 -51.89 34.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.634 -0.666 . . . . 0.0 110.256 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.526 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.7 m -71.45 -43.69 66.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.376 -0.827 . . . . 0.0 110.932 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 46.4 tp10 -66.72 -50.26 63.38 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.086 -1.009 . . . . 0.0 111.223 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 24.9 mmtp -75.83 -26.54 57.29 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.021 -1.049 . . . . 0.0 111.402 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.431 ' HG2' HD21 ' A' ' 116' ' ' LEU . 29.1 tptt -125.33 -30.46 3.14 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.043 -1.036 . . . . 0.0 111.82 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.3 OUTLIER 59.66 45.11 13.46 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.737 -1.227 . . . . 0.0 110.206 179.672 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.431 HD21 ' HG2' ' A' ' 114' ' ' LYS . 84.6 mt -69.57 -32.15 70.76 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.136 -0.978 . . . . 0.0 111.288 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 118' ' ' THR . 32.0 t -153.12 -167.04 2.6 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.515 -1.274 . . . . 0.0 112.064 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.531 ' N ' ' OG ' ' A' ' 117' ' ' SER . 40.1 p -129.81 155.26 80.75 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 121.835 -0.541 . . . . 0.0 109.695 -178.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -54.01 -40.63 80.4 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.112 1.875 . . . . 0.0 112.122 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.79 88.59 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.821 -1.174 . . . . 0.0 109.254 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -66.67 -45.25 79.53 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.571 HD21 ' HG3' ' A' ' 103' ' ' MET . 34.6 tp -65.97 -51.77 55.5 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.639 -0.663 . . . . 0.0 109.952 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -57.26 -47.34 81.67 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.234 -0.916 . . . . 0.0 109.533 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.84 90.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.402 -0.811 . . . . 0.0 109.873 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.653 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.46 -36.09 78.51 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 122.055 0.931 . . . . 0.0 108.547 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.427 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 34.1 mt -65.59 -48.33 83.05 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.031 0 CA-C-O 121.521 0.677 . . . . 0.0 109.191 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -64.19 -37.22 86.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.406 -0.809 . . . . 0.0 109.095 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.6 -36.01 92.62 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.798 HD21 HH12 ' A' ' 99' ' ' ARG . 0.1 OUTLIER -93.87 -36.0 12.43 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.115 -1.226 . . . . 0.0 110.63 -178.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.662 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 57.4 mtp180 -66.75 148.93 51.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.677 -1.264 . . . . 0.0 109.778 179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.63 171.34 0.32 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.283 -0.886 . . . . 0.0 108.982 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -110.74 -156.59 0.59 Allowed 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.464 -0.772 . . . . 0.0 109.019 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 179.99 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.405 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O4'-C1'-C2' 108.244 1.949 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.597 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.906 0 O4'-C1'-C2' 108.805 2.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.108 0 O4'-C4'-C3' 107.38 1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.233 0 O5'-C5'-C4' 113.317 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O5'-C5'-C4' 113.008 2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.962 0 O5'-C5'-C4' 113.219 2.156 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.875 0 O5'-C5'-C4' 112.851 1.893 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.6 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.522 1.406 0 O4'-C1'-C2' 108.404 2.095 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . 0.533 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.337 0 O5'-C5'-C4' 113.209 2.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.292 0 O4'-C4'-C3' 107.842 2.242 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O5'-C5'-C4' 113.154 2.11 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . 0.429 ' N2 ' ' C2 ' ' C' ' 420' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.405 0 O5'-C5'-C4' 113.45 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . 0.412 ' H71' " C2'" ' B' ' 412' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.16 0 O4'-C4'-C3' 107.994 2.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.921 0 O4'-C4'-C3' 107.663 2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.162 0 O4'-C4'-C3' 108.026 2.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.806 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C1'-C2' 109.051 2.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.59 0 O4'-C1'-C2' 108.811 2.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.371 0 O5'-C5'-C4' 112.698 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.47 H5'' ' HZ2' ' A' ' 76' ' ' LYS . . . . . . . . 0 P--O5' 1.609 1.557 0 O5'-C5'-C4' 113.892 2.637 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.515 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 P--O5' 1.61 1.713 0 O5'-C5'-C4' 113.335 2.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.533 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.033 0 O5'-C5'-C4' 113.054 2.039 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.533 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O5'-C5'-C4' 113.625 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . 0.533 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.902 0 O5'-C5'-C4' 113.377 2.269 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.298 0 O4'-C1'-C2' 108.772 2.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.018 0 O4'-C4'-C3' 107.868 2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.424 0 O4'-C4'-C3' 107.394 1.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.758 0 O4'-C4'-C3' 107.84 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.882 0 O4'-C4'-C3' 107.605 2.005 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 113.101 2.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.782 0 O4'-C4'-C3' 107.595 1.995 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -111.61 87.24 2.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.364 -1.08 . . . . 0.0 109.47 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.82 138.15 51.1 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.307 -0.871 . . . . 0.0 109.833 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -56.74 -37.58 71.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.553 -0.717 . . . . 0.0 110.48 -178.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.38 -42.85 95.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.838 -1.164 . . . . 0.0 109.267 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -54.83 -45.38 74.44 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.238 -0.914 . . . . 0.0 109.138 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -67.28 -37.38 83.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 108.95 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -53.55 -48.52 69.03 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.308 -0.87 . . . . 0.0 109.471 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -62.45 -38.97 91.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.101 -0.999 . . . . 0.0 109.204 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.31 -48.74 72.04 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.77 . . . . 0.0 110.386 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.4 m -74.06 -34.67 39.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 O-C-N 120.761 -1.212 . . . . 0.0 108.218 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -54.65 -40.6 69.18 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 12.1 mm-40 -59.49 -31.08 69.03 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.7 mt -71.59 -35.94 70.69 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.829 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.7 m-85 -81.54 -32.24 32.36 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.536 -1.352 . . . . 0.0 110.458 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.6 mt-10 -67.73 -31.02 70.67 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.827 -1.171 . . . . 0.0 110.432 -178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.525 HD12 ' HA ' ' A' ' 16' ' ' LEU . 14.6 mt -35.28 -39.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.784 -0.572 . . . . 0.0 110.556 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.573 ' ND2' ' OD1' ' A' ' 22' ' ' ASP . 41.3 p-10 -173.72 167.06 4.5 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.97 -1.081 . . . . 0.0 110.034 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -94.22 64.75 3.27 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.624 -0.673 . . . . 0.0 109.821 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.573 ' OD1' ' ND2' ' A' ' 20' ' ' ASN . 1.7 m-20 -96.33 141.4 23.06 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.061 -1.024 . . . . 0.0 108.811 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.48 -61.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.14 1.893 . . . . 0.0 112.329 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -60.81 -34.09 74.01 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.858 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.718 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -55.53 -44.95 77.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.98 -1.075 . . . . 0.0 109.954 -179.109 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -61.89 -54.71 38.28 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.04 -1.037 . . . . 0.0 109.287 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.05 -37.91 61.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 108.872 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -61.37 -62.81 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.396 -0.815 . . . . 0.0 109.392 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.503 HD11 ' NH1' ' A' ' 25' ' ' ARG . 69.2 mt -54.17 -47.74 71.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.538 -0.726 . . . . 0.0 109.684 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.31 -49.26 77.72 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.197 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -66.63 -42.3 86.99 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 120.998 -1.064 . . . . 0.0 109.635 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.3 tp -57.67 -52.53 65.06 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.271 -0.893 . . . . 0.0 110.356 -178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -60.54 -34.34 73.99 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.984 -1.486 . . . . 0.0 107.74 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 27.3 m -69.29 -53.43 19.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.372 -0.83 . . . . 0.0 109.51 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.409 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 72.2 t80 -59.51 -40.13 86.07 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.568 -0.707 . . . . 0.0 110.57 -179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 75.3 mmm -58.96 -37.8 77.61 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.333 -0.854 . . . . 0.0 110.83 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -62.93 -39.41 94.49 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.909 -1.119 . . . . 0.0 110.286 -179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -69.47 -30.58 68.5 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 120.91 -1.119 . . . . 0.0 108.358 179.417 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.431 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -67.27 -30.58 70.49 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 98.76 -2.21 58.47 Favored Glycine 0 N--CA 1.483 1.821 0 N-CA-C 107.389 -2.284 . . . . 0.0 107.389 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 75.2 p -118.86 84.41 25.6 Favored Pre-proline 0 N--CA 1.491 1.597 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -83.02 137.15 8.4 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.561 2.174 . . . . 0.0 111.082 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.9 mt -73.98 97.73 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.038 -1.038 . . . . 0.0 109.94 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -65.41 -43.68 89.81 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.578 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.33 133.4 38.78 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.422 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.4 mt -70.33 146.64 94.6 Favored Pre-proline 0 C--N 1.298 -1.65 0 C-N-CA 118.72 -1.192 . . . . 0.0 108.528 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -67.08 127.29 16.54 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 121.209 1.273 . . . . 0.0 109.186 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.569 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.0 mt -96.11 143.67 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.848 -1.158 . . . . 0.0 109.763 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.841 ' SD ' HG21 ' A' ' 97' ' ' THR . 57.3 mmm -140.54 123.35 16.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.669 0.747 . . . . 0.0 108.991 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.4 41.42 3.27 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.1 mttt 57.93 23.32 9.7 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.45 0.643 . . . . 0.0 109.89 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 89.7 p -136.98 155.62 49.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 108.936 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.28 148.42 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.972 -1.08 . . . . 0.0 109.266 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HG3' ' A' ' 49' ' ' MET . 34.5 tp -81.66 122.91 28.22 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.685 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -65.17 89.43 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.323 -0.861 . . . . 0.0 109.07 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.5 mt -56.06 -23.54 34.13 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 120.786 -1.196 . . . . 0.0 109.168 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -78.43 -56.21 4.62 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.36 -0.838 . . . . 0.0 111.437 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.81 -39.33 91.35 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.815 -1.178 . . . . 0.0 110.132 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.1 tp -59.7 -44.28 93.75 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.083 -1.011 . . . . 0.0 108.286 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HD1' ' HH ' ' A' ' 102' ' ' TYR . 52.9 t80 -56.21 -67.17 0.32 Allowed 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -43.17 -39.16 2.75 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 111.138 -178.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.579 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 7.8 mt -70.66 -44.36 67.25 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 118.057 -1.457 . . . . 0.0 107.562 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.82 HG21 ' CE2' ' A' ' 102' ' ' TYR . 48.6 t -59.44 -45.05 93.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.264 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 64' ' ' ILE . 6.0 mm -68.22 -34.8 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.637 -1.289 . . . . 0.0 108.367 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.58 -26.95 35.52 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.774 -0.578 . . . . 0.0 110.358 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.9 mpt_? -90.74 -0.55 57.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.441 -1.412 . . . . 0.0 108.914 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.54 19.74 61.44 Favored Glycine 0 N--CA 1.489 2.221 0 C-N-CA 120.386 -0.912 . . . . 0.0 111.808 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.412 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 138.44 131.9 2.93 Favored Glycine 0 N--CA 1.499 2.838 0 O-C-N 120.672 -1.487 . . . . 0.0 111.418 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.553 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.1 tp -49.65 -39.54 36.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.617 -0.931 . . . . 0.0 109.914 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 122' ' ' LEU . 83.4 t -58.29 -43.22 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.212 -0.93 . . . . 0.0 109.907 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -54.99 -39.37 68.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.725 -1.234 . . . . 0.0 109.045 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.599 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.0 t -63.37 -42.11 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.49 -0.756 . . . . 0.0 109.845 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.469 HG12 HH11 ' A' ' 99' ' ' ARG . 72.7 mt -66.61 -58.52 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.661 -1.274 . . . . 0.0 110.454 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -56.64 -42.47 78.97 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.36 -9.46 38.73 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.22 -0.925 . . . . 0.0 110.826 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 72' ' ' VAL . 40.3 mttp 58.17 60.81 2.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.211 -0.93 . . . . 0.0 110.292 -178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 15.7 mt -93.23 16.24 13.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.017 -1.052 . . . . 0.0 108.497 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.553 ' HH2' HD11 ' A' ' 69' ' ' LEU . 82.3 m95 -64.78 -39.07 93.01 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.424 ' C ' ' O ' ' A' ' 78' ' ' TRP . 97.1 mm-40 -49.54 -38.28 30.28 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 118.425 -1.31 . . . . 0.0 108.093 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.9 mt-10 -69.26 -40.57 77.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 mt -71.75 -53.33 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.431 -0.793 . . . . 0.0 109.062 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.653 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.1 mt -51.48 -53.7 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 109.19 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -68.94 -39.15 79.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.223 -0.923 . . . . 0.0 110.201 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.7 -32.63 47.5 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.458 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 1.1 mm? -89.18 -7.95 54.61 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.385 -1.068 . . . . 0.0 108.7 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 63.96 42.34 5.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.837 -0.54 . . . . 0.0 110.331 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 142.16 83.62 Favored Pre-proline 0 N--CA 1.488 1.469 0 O-C-N 121.201 -0.937 . . . . 0.0 108.934 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.582 ' C ' ' H ' ' A' ' 90' ' ' SER . 36.5 Cg_endo -69.86 143.2 49.59 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 C-N-CA 122.063 1.842 . . . . 0.0 112.456 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.7 p -55.61 -1.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.414 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.582 ' H ' ' C ' ' A' ' 88' ' ' PRO . 23.3 m -64.43 -34.19 77.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 110.154 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.552 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.0 mt -90.99 97.5 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 120.738 -1.226 . . . . 0.0 109.243 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 69.1 p -70.45 -21.92 62.75 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.284 -0.885 . . . . 0.0 109.194 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 57.9 m -104.25 43.37 1.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.467 -0.771 . . . . 0.0 109.159 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.39 -61.19 2.26 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.331 -0.856 . . . . 0.0 109.319 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.653 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.4 -50.47 30.8 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 109.807 -179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.403 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 7.7 tp -58.02 -46.06 85.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.765 -1.209 . . . . 0.0 109.116 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.841 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.2 m -58.92 -41.08 86.44 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.047 -1.033 . . . . 0.0 108.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.5 mt -70.19 -44.46 68.66 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.416 -0.802 . . . . 0.0 109.507 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.469 ' HG3' HH11 ' A' ' 99' ' ' ARG . 6.7 ttm-85 -65.81 -55.04 19.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.981 -1.074 . . . . 0.0 111.017 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 59.4 m -57.22 -52.9 63.46 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.436 -0.79 . . . . 0.0 111.003 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.66 -43.79 97.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.071 -1.018 . . . . 0.0 111.715 -178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.82 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.1 t80 -57.69 -39.65 77.66 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 120.356 -1.465 . . . . 0.0 109.595 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.573 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -54.46 -54.72 37.12 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.28 -0.888 . . . . 0.0 111.65 -178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -72.87 -52.88 13.03 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 120.477 -1.389 . . . . 0.0 113.198 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -84.68 -50.33 7.73 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.571 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.2 mp -97.2 6.23 48.78 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.235 -1.541 . . . . 0.0 113.863 -176.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.596 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 68.8 t80 -67.74 -37.01 10.85 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 119.955 -1.716 . . . . 0.0 111.684 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 60.6 Cg_endo -78.75 -40.98 0.26 Allowed 'Trans proline' 0 C--N 1.314 -1.286 0 C-N-CA 121.354 1.369 . . . . 0.0 112.096 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -58.54 -42.97 89.07 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -70.86 -46.04 63.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.599 -0.688 . . . . 0.0 110.072 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.1 t -77.03 -45.81 25.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.337 -0.852 . . . . 0.0 110.611 -178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 108' ' ' PRO . 40.5 tp10 -66.22 -47.13 74.82 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.099 -1.001 . . . . 0.0 110.856 -178.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -76.61 -33.63 58.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.095 -1.003 . . . . 0.0 111.417 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.492 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.6 tptp -119.6 -27.43 5.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 111.783 -177.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 111' ' ' CYS . 24.1 t-20 55.76 45.34 24.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.78 -1.2 . . . . 0.0 110.389 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 114' ' ' LYS . 73.1 mt -67.24 -31.34 71.63 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.176 -0.952 . . . . 0.0 110.966 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 118' ' ' THR . 29.5 t -154.65 -167.0 2.47 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 118.746 -1.182 . . . . 0.0 111.576 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.522 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.6 p -122.06 152.67 60.34 Favored Pre-proline 0 N--CA 1.497 1.907 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.596 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 10.9 Cg_endo -55.85 -38.76 94.09 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 C-N-CA 121.883 1.722 . . . . 0.0 112.092 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.95 -37.71 88.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.98 -1.075 . . . . 0.0 109.539 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.431 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.7 mt-10 -66.96 -43.42 83.15 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 178.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.573 HD21 ' HG3' ' A' ' 103' ' ' MET . 15.6 tp -64.31 -52.92 56.11 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.536 -0.728 . . . . 0.0 109.657 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -58.62 -47.25 84.99 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.331 -0.855 . . . . 0.0 109.794 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.12 -38.68 87.21 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 110.033 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -66.84 -34.04 76.92 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.543 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -68.42 -45.61 81.93 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 N-CA-C 108.102 -1.074 . . . . 0.0 108.102 177.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.477 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 62.5 t0 -58.94 -40.05 83.47 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.046 -1.034 . . . . 0.0 108.799 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.14 -26.83 73.73 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 17.5 p-10 -89.49 -31.82 17.49 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.766 -1.432 . . . . 0.0 110.595 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.652 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 85.5 mtm180 -62.85 142.06 58.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.662 -1.273 . . . . 0.0 110.083 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -67.14 147.97 52.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.813 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -76.11 -4.23 40.39 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 179.986 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -1.955 0 O4'-C1'-C2' 108.406 2.096 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.102 0 O4'-C4'-C3' 107.757 2.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.848 0 O4'-C4'-C3' 107.602 2.002 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.086 0 O4'-C4'-C3' 107.863 2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O5'-C5'-C4' 112.809 1.864 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.939 0 O5'-C5'-C4' 113.011 2.008 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.852 0 O5'-C5'-C4' 112.927 1.948 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.569 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.182 0 O4'-C4'-C3' 107.807 2.207 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.281 0 O5'-C5'-C4' 113.105 2.075 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O4'-C4'-C3' 107.793 2.193 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.994 0 O5'-C5'-C4' 113.137 2.098 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.246 2.176 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.095 0 O4'-C4'-C3' 108.146 2.546 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.834 0 O4'-C4'-C3' 107.454 1.854 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.978 0 O4'-C4'-C3' 107.885 2.285 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.821 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.972 0 O4'-C1'-C2' 109.002 2.638 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.599 0 C4'-C3'-C2' 105.733 2.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.403 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O5'-C5'-C4' 112.784 1.846 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.448 0 O5'-C5'-C4' 113.7 2.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.422 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.425 -1.927 0 O4'-C4'-C3' 107.913 2.313 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.403 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O5'-C5'-C4' 113.1 2.071 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O5'-C5'-C4' 113.547 2.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 113.372 2.266 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.321 0 O4'-C1'-C2' 108.663 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.272 0 O4'-C4'-C3' 107.533 1.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.953 0 O5'-C5'-C4' 113.226 2.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.026 0 O5'-C5'-C4' 113.058 2.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.068 0 O4'-C4'-C3' 107.806 2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.096 0 C1'-O4'-C4' 106.282 -2.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.584 ' O ' ' N ' ' A' ' 5' ' ' SER . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.445 ' C ' ' O ' ' A' ' 3' ' ' GLY . 26.5 t90 -37.86 90.61 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.665 -0.903 . . . . 0.0 110.125 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.584 ' N ' ' O ' ' A' ' 3' ' ' GLY . 0.1 OUTLIER -107.13 135.74 48.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.267 -0.896 . . . . 0.0 109.29 179.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -58.59 -40.76 84.11 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.516 -0.74 . . . . 0.0 111.104 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.26 -42.39 98.55 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.917 -1.114 . . . . 0.0 109.898 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -50.56 -35.15 28.45 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.365 -0.835 . . . . 0.0 110.025 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.608 ' NE2' ' O ' ' A' ' 43' ' ' ILE . 36.2 mt-30 -69.86 -41.58 74.65 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.922 -1.111 . . . . 0.0 111.116 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -54.24 -49.54 69.24 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.694 -1.254 . . . . 0.0 110.052 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -62.02 -42.32 99.03 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.068 -1.02 . . . . 0.0 109.453 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.04 -47.27 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.261 -0.899 . . . . 0.0 110.891 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.582 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.7 m -72.67 -36.7 53.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 120.58 -1.325 . . . . 0.0 108.8 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -53.49 -40.44 65.36 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 178.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -59.45 -31.3 69.18 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.466 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -72.91 -36.33 67.24 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.462 -0.773 . . . . 0.0 111.633 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.481 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 97.7 m-85 -79.05 -33.38 44.76 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.318 -1.489 . . . . 0.0 110.769 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.5 mm-40 -67.18 -26.35 66.6 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.888 -1.132 . . . . 0.0 110.528 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.474 ' C ' ' O ' ' A' ' 18' ' ' GLU . 28.7 mt -37.79 -39.55 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 121.617 -0.677 . . . . 0.0 110.694 -178.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -171.65 163.76 6.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.752 -1.218 . . . . 0.0 110.321 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -90.0 65.18 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.696 -0.627 . . . . 0.0 110.213 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -112.44 95.87 33.52 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.464 -0.773 . . . . 0.0 108.976 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -47.61 -40.16 30.2 Favored 'Trans proline' 0 N--CA 1.493 1.441 0 C-N-CA 122.358 2.038 . . . . 0.0 112.272 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -60.91 -41.1 95.46 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.02 -1.05 . . . . 0.0 108.592 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.706 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -59.79 -39.02 83.55 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.485 -0.76 . . . . 0.0 109.416 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.593 ' NZ ' ' OD2' ' A' ' 30' ' ' ASP . 57.7 tttm -59.94 -50.58 73.2 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.16 -39.17 63.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -63.42 -61.86 2.06 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.486 -0.759 . . . . 0.0 109.539 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.566 HD21 HH12 ' A' ' 25' ' ' ARG . 74.7 mt -56.14 -46.73 79.13 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.345 -0.847 . . . . 0.0 109.067 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.593 ' OD2' ' NZ ' ' A' ' 26' ' ' LYS . 70.3 m-20 -62.29 -52.14 64.91 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.702 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.81 -40.87 92.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.244 -0.91 . . . . 0.0 109.188 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -57.23 -55.69 31.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.334 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.9 m-85 -60.63 -34.05 73.69 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.08 -1.448 . . . . 0.0 107.979 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -69.96 -52.95 20.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.514 -0.741 . . . . 0.0 110.614 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -60.19 -43.57 95.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 111.908 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 98.1 mtp -57.86 -34.36 69.67 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.095 -1.003 . . . . 0.0 111.123 -178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -54.12 -40.18 67.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.622 -1.299 . . . . 0.0 108.169 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -67.21 -37.53 83.78 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.469 -0.769 . . . . 0.0 109.358 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.418 ' NE ' ' HB3' ' A' ' 108' ' ' PRO . 16.6 mmm180 -63.5 -31.66 72.88 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.729 -0.607 . . . . 0.0 109.602 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.41 -2.96 61.2 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 108.238 -1.945 . . . . 0.0 108.238 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 39.6 p -118.99 85.18 28.41 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -83.49 144.6 11.48 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.58 2.187 . . . . 0.0 111.666 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.608 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 8.9 mt -77.13 94.07 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.109 -0.995 . . . . 0.0 109.264 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -61.0 -35.33 76.57 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.617 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -148.44 136.04 20.61 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.466 HD13 ' CD1' ' A' ' 16' ' ' LEU . 1.7 mt -71.45 145.49 90.43 Favored Pre-proline 0 C--N 1.297 -1.692 0 O-C-N 120.987 -1.071 . . . . 0.0 109.003 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -67.39 133.69 31.05 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 N-CA-C 108.982 -1.199 . . . . 0.0 108.982 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.517 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 5.7 mt -101.59 145.51 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.887 -1.133 . . . . 0.0 109.945 -178.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.739 ' SD ' HD13 ' A' ' 54' ' ' LEU . 81.3 mtp -144.67 118.74 9.42 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 73.15 37.98 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mttt 57.79 25.15 11.59 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.639 0.733 . . . . 0.0 109.29 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 93.3 p -136.85 154.87 50.39 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.3 m -68.04 145.32 13.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 O-C-N 121.176 -0.953 . . . . 0.0 109.076 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.739 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.8 tp -77.92 123.61 27.0 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.306 -0.872 . . . . 0.0 109.512 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -62.89 88.51 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.8 mt -53.96 -25.43 20.65 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.87 -1.144 . . . . 0.0 108.957 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -78.86 -52.69 7.97 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.342 -0.849 . . . . 0.0 111.984 -178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -64.38 -37.34 87.19 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.556 -1.34 . . . . 0.0 110.165 -178.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.615 HD13 HD22 ' A' ' 98' ' ' LEU . 56.4 tp -58.79 -44.03 90.62 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 178.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.969 ' CE1' HD11 ' A' ' 64' ' ' ILE . 56.6 t80 -56.36 -73.66 0.06 Allowed 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.782 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -39.36 -41.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.257 -0.902 . . . . 0.0 111.782 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 9.2 mt -71.46 -44.48 64.71 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 117.943 -1.503 . . . . 0.0 107.945 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.682 HG21 ' CE2' ' A' ' 102' ' ' TYR . 19.1 t -59.34 -46.69 92.3 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 110.164 179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.969 HD11 ' CE1' ' A' ' 60' ' ' TYR . 5.5 mm -68.99 -35.59 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.769 -1.207 . . . . 0.0 107.843 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.415 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -53.57 -23.0 9.5 Favored 'General case' 0 C--N 1.301 -1.538 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.628 -178.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.521 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.4 mpt_? -92.26 -1.94 56.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.648 -1.283 . . . . 0.0 108.782 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.48 19.47 64.07 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.166 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.07 127.54 2.23 Favored Glycine 0 N--CA 1.5 2.929 0 CA-C-N 119.596 1.698 . . . . 0.0 111.846 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.567 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.7 tp -46.91 -39.39 12.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.586 -0.95 . . . . 0.0 109.526 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.6 t -59.43 -42.1 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.223 -0.923 . . . . 0.0 109.656 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -55.01 -42.7 72.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.036 -1.04 . . . . 0.0 109.47 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 76' ' ' LYS . 22.5 t -63.28 -43.42 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.468 -0.77 . . . . 0.0 110.201 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -64.95 -56.72 14.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 O-C-N 120.813 -1.179 . . . . 0.0 110.45 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -57.38 -41.94 81.18 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -93.6 -9.91 36.45 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.029 -1.044 . . . . 0.0 110.436 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 72' ' ' VAL . 38.6 mtmt 58.73 59.96 2.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.441 -0.787 . . . . 0.0 109.772 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.3 mt -93.01 14.38 17.89 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.189 -0.945 . . . . 0.0 108.663 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.485 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.8 m95 -62.27 -39.38 92.73 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.43 ' NE2' ' OP2' ' C' ' 419' ' ' ' DC' . 87.6 mm-40 -49.08 -39.29 27.38 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.722 -1.236 . . . . 0.0 108.386 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HB3' HH21 ' A' ' 66' ' ' ARG . 77.1 mm-40 -69.83 -39.54 76.4 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt -71.08 -54.87 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.295 -0.878 . . . . 0.0 108.881 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.622 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.1 mt -51.24 -55.61 7.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.331 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -68.41 -36.8 79.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.063 -1.023 . . . . 0.0 109.206 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.45 -34.99 49.95 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.6 mt -88.27 -7.25 57.06 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.351 -1.088 . . . . 0.0 108.667 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 66.54 40.58 3.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.236 0.541 . . . . 0.0 110.004 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.43 142.87 81.92 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.939 . . . . 0.0 108.545 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.563 ' C ' ' H ' ' A' ' 90' ' ' SER . 42.3 Cg_endo -70.34 144.28 50.46 Favored 'Trans proline' 0 C--N 1.31 -1.482 0 C-N-CA 122.142 1.895 . . . . 0.0 112.301 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 p -57.57 -0.35 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.205 -0.935 . . . . 0.0 109.486 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 88' ' ' PRO . 13.8 m -65.01 -30.74 71.74 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.354 -0.841 . . . . 0.0 109.844 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.429 HD11 ' N ' ' A' ' 50' ' ' ALA . 70.8 mt -93.81 97.54 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 120.656 -1.278 . . . . 0.0 109.274 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.6 p -71.87 -25.0 61.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.938 . . . . 0.0 109.345 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 m -101.88 41.77 1.19 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.64 -59.58 3.02 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.349 -0.845 . . . . 0.0 109.252 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.622 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.22 -52.6 15.44 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.152 -0.967 . . . . 0.0 109.038 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.46 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.0 tp -58.63 -44.63 90.07 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.06 -1.025 . . . . 0.0 109.214 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.3 m -60.2 -40.27 89.47 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.116 -0.99 . . . . 0.0 108.903 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.615 HD22 HD13 ' A' ' 59' ' ' LEU . 9.6 mt -68.77 -46.08 69.69 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.614 -0.679 . . . . 0.0 109.786 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.52 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 37.4 ttm180 -64.94 -51.42 61.95 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.333 -0.854 . . . . 0.0 110.884 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -54.69 -54.75 37.69 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.671 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -62.59 -42.0 99.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.149 -0.969 . . . . 0.0 111.559 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.682 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.2 t80 -58.02 -43.33 86.64 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 120.207 -1.558 . . . . 0.0 109.256 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.705 ' HG2' HD21 ' A' ' 122' ' ' LEU . 85.3 mtp -53.36 -57.43 10.62 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.734 -0.604 . . . . 0.0 112.325 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -72.82 -51.26 19.6 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.671 -1.268 . . . . 0.0 112.79 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.4 ' C ' HD12 ' A' ' 106' ' ' LEU . 71.2 m-85 -84.27 -47.41 10.8 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.545 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.5 mp -98.86 -1.43 40.18 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.33 -1.481 . . . . 0.0 114.035 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.643 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 81.1 t80 -63.12 -36.86 27.19 Favored Pre-proline 0 N--CA 1.496 1.866 0 O-C-N 119.746 -1.846 . . . . 0.0 110.337 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.643 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.2 Cg_exo -67.07 -56.39 0.24 Allowed 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.145 1.896 . . . . 0.0 111.855 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.76 -43.44 85.45 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -72.95 -49.9 26.59 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.301 -0.874 . . . . 0.0 110.641 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.4 t -76.8 -43.05 38.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.156 -0.965 . . . . 0.0 111.199 -178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.402 ' N ' ' O ' ' A' ' 108' ' ' PRO . 43.5 tp10 -68.8 -50.35 50.93 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.577 -1.327 . . . . 0.0 110.996 -178.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -74.0 -35.76 64.44 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.115 -0.991 . . . . 0.0 111.699 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.2 tptp -111.02 -29.04 8.06 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.838 -1.163 . . . . 0.0 111.612 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 54.61 44.67 28.3 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.643 -1.286 . . . . 0.0 110.607 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.662 HD11 HG23 ' A' ' 64' ' ' ILE . 73.5 mt -66.07 -30.88 71.48 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.117 -0.989 . . . . 0.0 110.398 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -154.24 -166.7 2.43 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.406 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 74.2 p -127.53 159.81 63.82 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.595 -0.691 . . . . 0.0 109.753 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.45 -39.28 90.24 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.613 1.542 . . . . 0.0 112.256 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.59 -37.95 89.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.969 -1.082 . . . . 0.0 109.775 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -66.4 -44.73 82.2 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD21 ' HG2' ' A' ' 103' ' ' MET . 26.6 tp -66.66 -51.72 53.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.349 0.595 . . . . 0.0 110.08 179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -57.74 -47.02 83.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.308 -0.87 . . . . 0.0 109.863 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.13 91.91 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.238 -0.914 . . . . 0.0 109.877 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.96 -34.33 75.15 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.939 0.876 . . . . 0.0 108.7 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.7 HD11 ' SD ' ' A' ' 103' ' ' MET . 13.2 mt -63.59 -52.24 60.12 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -61.74 -36.85 82.17 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.458 -0.897 . . . . 0.0 109.04 179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.84 -31.64 81.08 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.666 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.92 -35.62 14.62 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.055 -1.262 . . . . 0.0 111.183 -178.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.666 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.7 mtm180 -62.6 143.52 57.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.714 -1.241 . . . . 0.0 110.203 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.552 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.4 mpt_? -70.9 166.54 20.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.633 -0.667 . . . . 0.0 109.935 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -104.35 110.06 22.16 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.365 -0.834 . . . . 0.0 109.29 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.459 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.832 0 O4'-C1'-C2' 108.399 2.09 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.577 0 O4'-C4'-C3' 107.783 2.183 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C4'-C3' 107.338 1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.077 0 O5'-C5'-C4' 113.271 2.194 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.716 0 O4'-C4'-C3' 107.556 1.956 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.727 0 O4'-C4'-C3' 107.72 2.12 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . 0.506 ' P ' ' HE ' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.607 1.387 0 O4'-C4'-C3' 107.289 1.689 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.517 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.172 0 O4'-C4'-C3' 107.825 2.225 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . 0.464 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.301 0 O5'-C5'-C4' 113.381 2.272 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.414 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O5'-C5'-C4' 113.478 2.341 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O5'-C5'-C4' 112.953 1.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.066 0 O5'-C5'-C4' 113.712 2.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.964 0 O4'-C4'-C3' 107.29 1.69 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.968 0 O4'-C4'-C3' 107.964 2.364 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.435 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.42 -2.373 0 C4'-C3'-C2' 104.686 1.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.435 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.14 0 O4'-C4'-C3' 108.045 2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.801 0 O5'-C5'-C4' 112.63 1.736 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.43 ' OP2' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 O4'--C4' 1.429 -1.536 0 O5'-C5'-C4' 113.581 2.415 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.561 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.855 0 O4'-C4'-C3' 107.871 2.271 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.469 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.259 0 O5'-C5'-C4' 113.236 2.168 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.469 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.13 0 O5'-C5'-C4' 113.578 2.413 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . 0.464 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.079 0 O5'-C5'-C4' 113.181 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.387 0 O4'-C1'-C2' 108.727 2.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O5'-C5'-C4' 113.375 2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.341 0 O4'-C4'-C3' 107.542 1.942 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.505 0 O5'-C5'-C4' 113.316 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.975 0 O5'-C5'-C4' 112.906 1.933 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.073 0 O4'-C4'-C3' 107.8 2.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.061 0 C1'-O4'-C4' 106.577 -2.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.571 ' CG ' ' OD1' ' A' ' 44' ' ' ASN . 24.4 p90 -71.2 157.49 38.05 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.185 -1.185 . . . . 0.0 109.384 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.478 ' OG ' ' OE1' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -91.72 130.94 37.42 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.19 -0.944 . . . . 0.0 110.41 -178.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -55.95 -33.96 65.22 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.808 -0.557 . . . . 0.0 109.876 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.478 ' OE1' ' OG ' ' A' ' 5' ' ' SER . 57.8 mp0 -63.29 -42.01 99.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.042 -1.037 . . . . 0.0 108.801 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -58.58 -46.42 86.98 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.409 -0.807 . . . . 0.0 109.755 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.752 ' O ' HG13 ' A' ' 13' ' ' VAL . 1.8 mp0 -66.2 -39.33 89.56 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.039 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.17 -50.82 70.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.405 -0.809 . . . . 0.0 109.322 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.66 -41.66 99.18 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.055 -1.028 . . . . 0.0 109.213 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.58 -48.16 75.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.337 -0.852 . . . . 0.0 110.586 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.0 m -69.68 -37.15 73.34 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 120.674 -1.266 . . . . 0.0 107.796 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -54.52 -41.52 69.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -58.95 -29.91 67.49 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.304 -0.958 . . . . 0.0 108.762 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 46' ' ' LEU . 8.9 mt -72.42 -38.45 68.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 111.333 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.44 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.0 m-85 -76.67 -33.53 58.27 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.509 -1.369 . . . . 0.0 110.457 -178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 19' ' ' ILE . 98.3 mt-10 -65.72 -26.92 67.97 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.844 -1.16 . . . . 0.0 110.325 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.598 HG21 HH12 ' A' ' 25' ' ' ARG . 32.9 mt -38.39 -40.28 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 O-C-N 121.604 -0.685 . . . . 0.0 110.665 -179.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -170.74 164.45 8.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.744 -1.223 . . . . 0.0 110.758 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -89.84 68.38 7.41 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.396 0.617 . . . . 0.0 109.774 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -112.44 94.28 26.57 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.13 -41.72 40.61 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.01 1.807 . . . . 0.0 111.974 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -63.38 -41.72 98.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.107 -0.996 . . . . 0.0 108.611 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.598 HH12 HG21 ' A' ' 19' ' ' ILE . 66.3 ttt180 -58.68 -37.78 76.79 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.432 -0.793 . . . . 0.0 109.297 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -59.74 -49.35 78.06 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.359 -0.838 . . . . 0.0 108.845 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -54.62 -37.75 65.99 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.554 -0.716 . . . . 0.0 109.365 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -64.48 -61.22 2.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.269 -0.894 . . . . 0.0 110.695 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.45 ' O ' ' CD2' ' A' ' 33' ' ' PHE . 54.7 mt -54.7 -47.56 73.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.284 -0.885 . . . . 0.0 109.295 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.44 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 88.1 m-20 -62.13 -46.17 90.19 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 119.821 -0.752 . . . . 0.0 109.395 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -67.1 -44.42 80.04 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.189 -0.944 . . . . 0.0 109.389 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.8 tp -55.56 -51.26 67.68 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.429 -0.795 . . . . 0.0 109.924 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 47.9 m-85 -61.0 -34.83 75.42 Favored 'General case' 0 C--N 1.3 -1.556 0 C-N-CA 118.442 -1.303 . . . . 0.0 107.85 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -70.78 -52.84 18.08 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.559 -0.713 . . . . 0.0 110.524 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.68 -45.04 90.29 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.271 -0.893 . . . . 0.0 111.124 -178.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.6 mtp -58.38 -33.57 69.75 Favored 'General case' 0 C--N 1.296 -1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.22 -179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -52.78 -39.12 61.99 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.96 -1.087 . . . . 0.0 108.652 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 38' ' ' LYS . 39.3 mmtt -71.03 -37.35 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -65.21 -30.45 71.35 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.76 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.73 0.74 64.11 Favored Glycine 0 N--CA 1.485 1.965 0 N-CA-C 108.393 -1.883 . . . . 0.0 108.393 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.5 p -117.21 84.81 17.86 Favored Pre-proline 0 N--CA 1.491 1.58 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -83.77 141.14 9.53 Favored 'Trans proline' 0 C--N 1.301 -1.945 0 C-N-CA 122.507 2.138 . . . . 0.0 111.4 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.4 mt -76.36 97.5 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.997 -1.064 . . . . 0.0 109.725 -179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.571 ' OD1' ' CG ' ' A' ' 4' ' ' TRP . 24.5 t-20 -68.15 -45.94 72.18 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.414 ' NH1' H5'' ' B' ' 406' ' ' ' DA' . 16.5 mtm180 -130.03 132.16 46.12 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 16' ' ' LEU . 17.7 mt -70.17 128.3 91.61 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 120.889 -1.132 . . . . 0.0 109.879 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -53.32 126.35 21.37 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 N-CA-C 108.777 -1.278 . . . . 0.0 108.777 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.6 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 51.2 mt -99.34 142.28 15.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.946 -1.096 . . . . 0.0 110.187 -178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.647 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.6 mtp -137.99 124.43 20.7 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.77 40.42 3.21 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 57.27 22.84 8.11 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.332 0.587 . . . . 0.0 110.286 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.1 p -136.08 153.42 51.33 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.187 -0.946 . . . . 0.0 109.079 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -66.74 145.62 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.984 -1.072 . . . . 0.0 108.941 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.647 HD13 ' SD ' ' A' ' 49' ' ' MET . 49.6 tp -80.14 124.44 28.78 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.271 -0.893 . . . . 0.0 110.023 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.592 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.0 m-20 -63.73 88.59 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.4 mt -52.42 -24.86 8.55 Favored 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.883 -1.136 . . . . 0.0 109.235 -178.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -80.3 -57.86 3.41 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.237 -0.914 . . . . 0.0 111.938 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -56.81 -38.24 72.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.525 -1.359 . . . . 0.0 109.34 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.51 HD22 HD21 ' A' ' 54' ' ' LEU . 60.0 tp -58.75 -52.4 65.86 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.419 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -51.91 -66.36 0.4 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-O 121.374 0.607 . . . . 0.0 109.832 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -42.83 -43.11 3.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.508 -0.745 . . . . 0.0 111.636 -178.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.49 -40.75 70.02 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.136 -1.426 . . . . 0.0 107.402 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.787 HG21 ' CE2' ' A' ' 102' ' ' TYR . 44.1 t -60.99 -45.5 98.41 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 C-N-CA 119.611 -0.836 . . . . 0.0 109.516 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.419 HG13 ' CE2' ' A' ' 60' ' ' TYR . 13.9 mm -68.75 -45.97 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.747 -1.22 . . . . 0.0 107.886 178.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.53 -4.66 2.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.807 -0.558 . . . . 0.0 109.683 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.682 ' HG3' HD13 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -101.89 9.39 40.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.103 -0.998 . . . . 0.0 108.841 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.51 7.85 87.72 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.348 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 122.8 142.63 6.21 Favored Glycine 0 N--CA 1.501 2.989 0 O-C-N 121.015 -1.285 . . . . 0.0 110.999 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' OE2' ' A' ' 110' ' ' GLU . 14.8 tp -52.18 -41.41 62.61 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.714 -0.874 . . . . 0.0 110.77 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.481 HG11 ' HB3' ' A' ' 121' ' ' GLU . 76.2 t -57.25 -41.76 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.747 -1.221 . . . . 0.0 108.916 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -59.07 -38.79 80.28 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.936 -1.102 . . . . 0.0 109.381 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' LYS . 45.2 t -61.8 -46.86 95.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.329 -0.857 . . . . 0.0 110.208 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.9 mt -63.9 -61.3 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 O-C-N 121.072 -1.018 . . . . 0.0 109.979 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -58.89 -41.33 86.9 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.577 -0.702 . . . . 0.0 110.831 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -93.2 -7.36 45.45 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 120.978 -1.076 . . . . 0.0 110.985 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 72' ' ' VAL . 22.6 mtmt 57.4 56.99 4.66 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.125 -0.985 . . . . 0.0 110.492 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.682 HD13 ' HG3' ' A' ' 66' ' ' ARG . 18.2 mt -89.53 13.11 14.71 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ILE . 86.4 m95 -62.42 -42.86 99.76 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.635 -0.666 . . . . 0.0 109.362 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 78' ' ' TRP . 83.3 mm-40 -49.69 -38.32 32.53 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.806 -1.184 . . . . 0.0 108.33 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.581 ' OE1' ' NE ' ' A' ' 66' ' ' ARG . 98.6 mt-10 -68.92 -40.48 79.03 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -72.47 -54.28 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.473 -0.767 . . . . 0.0 109.172 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.51 HD11 ' HB2' ' A' ' 95' ' ' ALA . 73.1 mt -53.15 -52.87 26.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 121.26 -0.9 . . . . 0.0 109.219 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -69.27 -40.28 77.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 109.344 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.73 -33.73 42.81 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.8 mt -87.66 -8.32 56.31 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.376 -1.073 . . . . 0.0 108.851 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 65.26 39.89 5.15 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.4 mt -73.03 139.71 79.91 Favored Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.338 -0.851 . . . . 0.0 108.752 178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.6 Cg_endo -67.26 142.57 61.06 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.946 1.764 . . . . 0.0 111.892 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -61.37 1.16 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.268 -0.895 . . . . 0.0 109.826 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 88' ' ' PRO . 60.4 p -65.65 -24.31 67.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.263 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.483 HD11 ' H ' ' A' ' 50' ' ' ALA . 90.9 mt -98.13 106.31 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.957 -1.089 . . . . 0.0 109.001 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -78.5 -22.57 47.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.107 -0.995 . . . . 0.0 108.657 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 27.8 m -95.49 34.29 1.48 Allowed 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.01 -65.9 0.62 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.067 -1.021 . . . . 0.0 108.854 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.51 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.66 -52.85 27.97 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.304 -0.873 . . . . 0.0 109.52 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.488 ' O ' ' OG1' ' A' ' 100' ' ' THR . 6.4 tp -58.53 -44.29 89.5 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.861 -1.149 . . . . 0.0 109.044 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.7 m -61.79 -40.96 97.03 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 120.942 -1.099 . . . . 0.0 109.441 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.501 HD22 HD13 ' A' ' 59' ' ' LEU . 9.4 mt -68.38 -45.83 71.66 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.399 -0.813 . . . . 0.0 110.298 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.623 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 34.9 ttp180 -64.45 -49.85 69.85 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.136 -0.978 . . . . 0.0 110.622 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.3 OUTLIER -56.16 -54.82 40.59 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.112 -0.992 . . . . 0.0 109.804 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -62.58 -42.59 99.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.063 -1.023 . . . . 0.0 111.024 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.787 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -56.97 -43.17 81.36 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 120.441 -1.412 . . . . 0.0 109.44 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.66 ' CE ' HD11 ' A' ' 126' ' ' ILE . 42.5 mtt -54.32 -53.9 47.59 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.491 -0.755 . . . . 0.0 111.185 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.1 mttm -72.25 -57.14 4.47 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.895 -1.128 . . . . 0.0 112.47 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -83.02 -15.09 52.49 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -175.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 mt -137.17 17.87 2.98 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 120.082 -1.636 . . . . 0.0 112.893 -177.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.631 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 37.6 t80 -72.08 -35.01 3.17 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 120.153 -1.592 . . . . 0.0 110.617 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 72.9 Cg_endo -83.79 -39.06 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.757 1.638 . . . . 0.0 112.799 -179.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.61 -41.55 86.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.625 -1.297 . . . . 0.0 107.857 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.469 ' OE2' ' N ' ' A' ' 69' ' ' LEU . 79.0 tt0 -71.86 -50.79 26.39 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.538 -0.726 . . . . 0.0 110.067 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.578 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.9 t -74.92 -44.0 51.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.496 -0.753 . . . . 0.0 111.083 -178.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' A' ' 108' ' ' PRO . 38.8 tp10 -66.08 -47.36 74.53 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.901 -1.124 . . . . 0.0 110.605 -178.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -74.87 -33.94 62.16 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.162 -0.961 . . . . 0.0 111.163 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.458 ' HG2' HD21 ' A' ' 116' ' ' LEU . 32.8 tptt -120.52 -27.98 5.04 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.186 -0.946 . . . . 0.0 111.848 -177.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.578 ' N ' ' O ' ' A' ' 111' ' ' CYS . 35.5 t-20 57.25 44.91 21.25 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.564 -1.335 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.458 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.5 mt -67.52 -30.39 70.03 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.201 -0.937 . . . . 0.0 111.249 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.577 ' OG ' ' N ' ' A' ' 118' ' ' THR . 8.8 t -153.13 -169.1 3.22 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 118.553 -1.259 . . . . 0.0 111.743 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.577 ' N ' ' OG ' ' A' ' 117' ' ' SER . 70.1 p -126.47 163.23 41.85 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.754 -0.592 . . . . 0.0 109.643 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.6 -37.95 85.08 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 121.571 1.514 . . . . 0.0 111.971 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.54 -36.72 83.51 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.995 . . . . 0.0 109.037 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.481 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.5 mt-10 -66.87 -48.78 67.71 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.603 HD11 ' CE ' ' A' ' 103' ' ' MET . 56.5 tp -57.54 -58.01 10.18 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.525 -0.735 . . . . 0.0 109.974 178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.507 ' NE2' HD12 ' A' ' 126' ' ' ILE . 60.4 mm-40 -56.8 -45.71 82.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.496 -0.753 . . . . 0.0 109.394 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.13 -36.5 77.65 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 120.802 -1.186 . . . . 0.0 108.466 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.18 -35.91 74.29 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.66 HD11 ' CE ' ' A' ' 103' ' ' MET . 19.3 mt -60.14 -52.5 60.58 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.685 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 -64.31 -38.03 89.58 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.01 -30.25 69.71 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 110.588 -1.005 . . . . 0.0 110.588 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -94.85 -32.88 13.05 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.846 -1.385 . . . . 0.0 110.94 -178.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.72 HH22 ' P ' ' C' ' 421' ' ' ' DT' . 0.0 OUTLIER -61.45 143.61 55.57 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.773 -1.204 . . . . 0.0 109.362 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.555 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 0.3 OUTLIER -75.15 151.83 38.51 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.557 -0.714 . . . . 0.0 110.335 -179.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -91.29 105.25 17.65 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.295 -0.878 . . . . 0.0 108.736 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.74 0 O4'-C1'-C2' 108.203 1.912 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.283 0 O4'-C4'-C3' 107.701 2.101 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.86 0 O4'-C4'-C3' 107.484 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.273 0 O4'-C4'-C3' 107.837 2.237 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.703 0 O4'-C4'-C3' 107.612 2.012 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . 0.414 H5'' ' NH1' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.723 0 O4'-C4'-C3' 107.567 1.967 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.784 0 O4'-C4'-C3' 107.688 2.088 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.6 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.522 1.345 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.107 0 O5'-C5'-C4' 113.027 2.019 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.437 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C1'-C2' 108.634 2.304 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.437 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.047 0 O5'-C5'-C4' 113.266 2.19 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.746 0 O5'-C5'-C4' 113.23 2.164 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.745 0 O4'-C4'-C3' 107.803 2.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 0 O4'-C4'-C3' 107.338 1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.463 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.422 -2.156 0 C4'-C3'-C2' 104.675 1.475 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 2.048 0 O4'-C1'-C2' 108.877 2.524 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O5'-C5'-C4' 112.76 1.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.545 ' O2 ' ' NH2' ' A' ' 131' ' ' ARG . . . . . . . . 0 P--O5' 1.609 1.574 0 O5'-C5'-C4' 113.623 2.445 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.56 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C4'-C3' 107.641 2.041 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.72 ' P ' HH22 ' A' ' 130' ' ' ARG . . . . . . . . 0 P--O5' 1.616 2.28 0 O5'-C5'-C4' 113.085 2.06 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.289 0 O5'-C5'-C4' 113.483 2.345 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.82 2.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-C2' 108.827 2.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.116 0 O4'-C4'-C3' 108.157 2.557 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C4'-C3' 107.637 2.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.452 0 O4'-C4'-C3' 107.657 2.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.85 0 O5'-C5'-C4' 112.804 1.86 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O4'-C4'-C3' 107.781 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.412 -3.046 0 C1'-O4'-C4' 106.402 -2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.632 ' CE2' ' ND2' ' A' ' 44' ' ' ASN . 47.1 p90 -63.99 151.71 42.09 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.221 -1.164 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.9 136.03 35.71 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.374 -0.829 . . . . 0.0 109.683 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -56.17 -38.58 71.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.599 -0.688 . . . . 0.0 110.122 -178.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -64.44 -41.75 96.38 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.031 -1.043 . . . . 0.0 109.261 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -55.15 -42.96 73.76 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.256 -0.902 . . . . 0.0 109.676 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 13' ' ' VAL . 42.2 mm-40 -67.26 -39.1 86.06 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.955 . . . . 0.0 109.253 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.65 ' CZ ' ' NE ' ' A' ' 14' ' ' ARG . 52.4 t80 -54.91 -50.18 69.44 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.29 -0.881 . . . . 0.0 108.95 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -62.86 -40.78 98.55 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.025 -1.047 . . . . 0.0 109.59 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.65 -47.98 73.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.368 -0.832 . . . . 0.0 111.006 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.697 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -70.11 -38.06 73.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 120.702 -1.249 . . . . 0.0 108.992 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.65 ' NE ' ' CZ ' ' A' ' 10' ' ' PHE . 7.7 mmt-85 -55.91 -39.82 72.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.392 -1.443 . . . . 0.0 108.347 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -58.71 -29.0 66.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.453 ' CD1' HD13 ' A' ' 46' ' ' LEU . 10.9 mt -75.32 -39.51 59.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.404 -0.81 . . . . 0.0 111.634 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 97.4 m-85 -74.86 -34.16 62.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.5 -1.375 . . . . 0.0 110.578 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 19' ' ' ILE . 77.8 mm-40 -64.77 -26.99 68.59 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.923 -1.111 . . . . 0.0 110.154 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.49 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 41.8 mt -39.87 -40.8 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.764 0 O-C-N 121.72 -0.612 . . . . 0.0 110.652 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.49 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.4 m120 -171.13 160.95 6.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.716 -1.24 . . . . 0.0 110.448 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 52.3 p30 -91.65 64.42 4.9 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.49 0.662 . . . . 0.0 109.724 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -107.0 107.66 60.83 Favored Pre-proline 0 N--CA 1.489 1.502 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -46.87 -51.78 8.68 Favored 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.031 1.821 . . . . 0.0 112.513 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.16 -36.1 78.89 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.169 -0.957 . . . . 0.0 109.337 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.688 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -59.41 -44.97 92.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -62.32 -53.27 57.51 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.308 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -51.69 -37.67 51.75 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.525 -0.735 . . . . 0.0 109.208 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -62.01 -62.58 1.69 Allowed 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.468 -0.77 . . . . 0.0 110.318 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.495 HD11 ' NH1' ' A' ' 25' ' ' ARG . 57.5 mt -54.77 -45.45 74.24 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.487 -0.758 . . . . 0.0 109.148 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -61.73 -47.64 84.3 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.699 -0.8 . . . . 0.0 109.035 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -66.68 -44.82 80.75 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.415 -0.803 . . . . 0.0 109.762 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.43 -51.74 67.25 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.349 -0.844 . . . . 0.0 110.898 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.415 ' CE1' HD12 ' A' ' 43' ' ' ILE . 42.0 m-85 -62.53 -33.06 74.15 Favored 'General case' 0 C--N 1.301 -1.521 0 C-N-CA 118.104 -1.438 . . . . 0.0 108.207 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.3 m -68.99 -55.03 12.13 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.408 -0.807 . . . . 0.0 110.203 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.438 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 46.3 t80 -61.91 -38.45 88.43 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.894 . . . . 0.0 111.656 -178.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.5 mmm -58.22 -34.79 70.8 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.857 -1.152 . . . . 0.0 110.748 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -56.27 -37.63 70.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.772 -1.205 . . . . 0.0 109.25 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.1 -28.47 57.53 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 13.6 mmm180 -66.7 -32.05 73.1 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.733 -0.787 . . . . 0.0 109.428 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.55 -2.21 62.49 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.725 -2.15 . . . . 0.0 107.725 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.8 p -118.72 84.9 26.18 Favored Pre-proline 0 N--CA 1.49 1.545 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.17 12.34 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.527 2.151 . . . . 0.0 111.207 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.504 HG21 HD23 ' A' ' 46' ' ' LEU . 59.1 mt -80.82 99.59 4.42 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.048 -1.032 . . . . 0.0 110.042 -178.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 4' ' ' TRP . 27.5 m120 -79.11 -3.96 47.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.25 -0.906 . . . . 0.0 108.648 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -176.45 123.2 0.16 Allowed 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.279 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.504 HD23 HG21 ' A' ' 43' ' ' ILE . 0.6 OUTLIER -70.29 144.06 91.66 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 120.953 -1.092 . . . . 0.0 108.93 -179.368 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -67.08 138.85 48.89 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 121.501 1.467 . . . . 0.0 109.558 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.588 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 35.3 mt -105.55 142.69 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.02 -1.05 . . . . 0.0 110.269 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.58 ' SD ' HD13 ' A' ' 54' ' ' LEU . 80.3 mtp -134.52 125.71 27.89 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.49 40.03 8.59 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.5 mttt 58.94 25.02 13.22 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.857 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.547 ' N ' HG23 ' A' ' 48' ' ' ILE . 84.8 p -137.56 154.58 49.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.369 -0.832 . . . . 0.0 109.524 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.2 m -67.26 144.3 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.197 -0.939 . . . . 0.0 109.975 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.695 HD21 HD22 ' A' ' 59' ' ' LEU . 51.0 tp -77.16 122.63 25.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.544 -0.722 . . . . 0.0 109.396 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -61.86 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.656 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 mt -55.28 -26.87 42.86 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 120.92 -1.112 . . . . 0.0 109.149 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -78.1 -63.46 1.39 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.136 -0.978 . . . . 0.0 111.564 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -57.1 -38.73 73.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 120.684 -1.26 . . . . 0.0 110.267 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.695 HD22 HD21 ' A' ' 54' ' ' LEU . 39.9 tp -58.72 -43.47 90.14 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.546 -1.346 . . . . 0.0 107.853 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.586 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 55.2 t80 -60.03 -67.5 0.38 Allowed 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.412 0.625 . . . . 0.0 109.547 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -41.94 -41.4 2.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.515 -0.74 . . . . 0.0 111.429 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.1 -44.07 69.74 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.12 -1.432 . . . . 0.0 107.743 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.827 HG21 ' CE2' ' A' ' 102' ' ' TYR . 23.5 t -58.14 -45.22 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.393 -0.817 . . . . 0.0 110.403 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.586 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.1 mm -71.01 -33.43 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 120.735 -1.228 . . . . 0.0 108.313 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.425 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.47 -24.38 20.07 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.646 -178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.496 HH21 ' HB3' ' A' ' 80' ' ' GLU . 9.9 mpt_? -92.46 -2.55 56.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.809 -1.182 . . . . 0.0 108.799 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.1 16.74 66.55 Favored Glycine 0 N--CA 1.491 2.312 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.434 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 145.28 128.11 2.0 Allowed Glycine 0 N--CA 1.498 2.801 0 CA-C-N 119.675 1.737 . . . . 0.0 111.85 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.616 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.9 tp -46.92 -38.33 10.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.63 -0.924 . . . . 0.0 109.695 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 88.0 t -60.61 -41.19 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.455 -179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -58.61 -42.99 89.46 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.878 -1.139 . . . . 0.0 109.695 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 76' ' ' LYS . 61.9 t -59.68 -43.43 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 109.349 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 86.4 mt -66.84 -56.89 12.13 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 O-C-N 120.851 -1.156 . . . . 0.0 109.623 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.463 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.7 m-20 -57.79 -41.77 82.8 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.161 -0.962 . . . . 0.0 110.312 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -92.27 -9.58 41.55 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.178 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.616 ' N ' ' O ' ' A' ' 72' ' ' VAL . 28.3 mtmt 58.03 57.7 3.94 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.311 -0.868 . . . . 0.0 109.67 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 12.6 mt -92.98 16.6 12.33 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.949 -1.094 . . . . 0.0 108.52 179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' ILE . 92.1 m95 -64.26 -39.75 94.59 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.439 ' C ' ' O ' ' A' ' 78' ' ' TRP . 16.3 mm100 -48.81 -38.88 23.38 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.287 -1.365 . . . . 0.0 108.026 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.496 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.8 mm-40 -69.64 -40.92 76.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.6 mt -69.83 -54.47 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.776 HD11 ' HB2' ' A' ' 95' ' ' ALA . 75.5 mt -50.33 -54.2 9.53 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 mttt -68.4 -38.49 81.35 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.77 -34.0 50.16 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.1 mt -88.13 -8.33 55.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.35 -1.088 . . . . 0.0 108.823 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 66.25 39.5 4.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.781 -0.575 . . . . 0.0 109.934 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.0 mt -73.79 146.74 85.86 Favored Pre-proline 0 N--CA 1.491 1.618 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.547 ' C ' ' H ' ' A' ' 90' ' ' SER . 56.7 Cg_endo -74.04 139.96 27.69 Favored 'Trans proline' 0 C--N 1.312 -1.391 0 C-N-CA 122.081 1.854 . . . . 0.0 112.149 179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 96.1 p -56.38 -0.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.822 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.547 ' H ' ' C ' ' A' ' 88' ' ' PRO . 86.8 p -67.31 -24.2 65.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.157 -0.964 . . . . 0.0 110.12 -178.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 94' ' ' ALA . 81.5 mt -96.99 102.01 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 120.751 -1.218 . . . . 0.0 109.274 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 52.3 p -73.43 -28.04 61.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 108.899 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.447 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 69.4 m -92.04 30.51 1.41 Allowed 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -61.83 -65.55 0.67 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.287 -0.883 . . . . 0.0 108.684 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.776 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.37 -51.27 35.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 109.178 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.589 HD22 ' C7 ' ' C' ' 421' ' ' ' DT' . 5.5 tp -59.04 -42.71 90.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.976 -1.077 . . . . 0.0 108.756 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 52.2 m -60.99 -40.84 95.03 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.246 -0.909 . . . . 0.0 108.707 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -69.29 -48.18 62.4 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.608 -0.682 . . . . 0.0 109.929 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.5 tmm_? -65.89 -49.03 69.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.144 -0.973 . . . . 0.0 110.919 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -55.83 -54.73 40.95 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 109.846 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.7 -40.9 98.58 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.274 -0.891 . . . . 0.0 111.115 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.827 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.78 -41.05 81.24 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.454 -1.404 . . . . 0.0 109.571 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.586 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.1 ttm -53.65 -54.1 42.6 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.426 -0.796 . . . . 0.0 111.552 -178.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -72.0 -54.5 9.72 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.661 -1.275 . . . . 0.0 113.164 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -85.41 -44.59 12.63 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 102' ' ' TYR . 3.0 mt -97.96 -7.69 29.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.315 -1.49 . . . . 0.0 114.231 -175.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.651 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 21.8 t80 -59.87 -38.18 57.48 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 119.84 -1.788 . . . . 0.0 109.209 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.651 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 15.8 Cg_exo -67.71 -52.07 0.6 Allowed 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.333 2.022 . . . . 0.0 112.036 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -60.67 -38.45 84.98 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.515 -0.921 . . . . 0.0 108.515 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.612 ' CG ' HD12 ' A' ' 116' ' ' LEU . 59.7 tt0 -73.33 -52.2 14.72 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.619 -0.676 . . . . 0.0 109.95 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 73.0 m -71.24 -43.87 66.42 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.475 -0.766 . . . . 0.0 110.888 -178.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -67.77 -47.12 70.07 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.018 -1.051 . . . . 0.0 111.407 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mmtt -74.78 -33.59 62.29 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.99 -1.069 . . . . 0.0 112.145 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.47 -25.13 3.78 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.853 -1.154 . . . . 0.0 111.641 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 60.64 48.76 7.0 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.687 -1.258 . . . . 0.0 110.285 179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.612 HD12 ' CG ' ' A' ' 110' ' ' GLU . 18.5 mt -67.1 -33.85 76.35 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.106 -0.996 . . . . 0.0 111.264 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.556 ' OG ' ' N ' ' A' ' 118' ' ' THR . 26.6 t -155.43 -166.62 2.3 Favored 'General case' 0 N--CA 1.496 1.828 0 C-N-CA 118.74 -1.184 . . . . 0.0 111.315 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.556 ' N ' ' OG ' ' A' ' 117' ' ' SER . 69.7 p -130.6 156.76 79.26 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.562 -0.711 . . . . 0.0 110.078 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -51.72 -42.82 54.92 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 C-N-CA 121.906 1.737 . . . . 0.0 112.493 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.98 -38.96 93.25 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.743 -1.223 . . . . 0.0 109.512 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -65.64 -43.57 89.06 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.586 HD21 ' HG3' ' A' ' 103' ' ' MET . 24.8 tp -68.49 -50.49 51.94 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.65 -0.656 . . . . 0.0 110.087 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -57.72 -46.38 84.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.052 -1.03 . . . . 0.0 109.167 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.33 -41.21 96.65 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.405 -0.81 . . . . 0.0 109.941 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.463 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.0 -34.92 77.43 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.535 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 13.1 mt -65.12 -48.13 84.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -61.72 -37.57 84.68 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.952 -1.092 . . . . 0.0 108.256 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.41 -33.0 86.07 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.585 -1.006 . . . . 0.0 110.585 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.6 p-10 -93.11 -31.77 14.69 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 120.797 -1.413 . . . . 0.0 110.267 -179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.6 mtp180 -64.82 143.35 58.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.761 -1.212 . . . . 0.0 109.521 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.507 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.0 mpt_? -65.16 151.16 46.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.383 -0.823 . . . . 0.0 109.922 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -84.54 96.26 9.09 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.346 -0.847 . . . . 0.0 108.952 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.899 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.427 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.425 -1.918 0 O4'-C1'-C2' 108.187 1.897 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.475 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-C2' 108.638 2.307 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.735 0 O4'-C4'-C3' 107.573 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.084 0 O5'-C5'-C4' 113.25 2.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.798 0 O5'-C5'-C4' 113.048 2.034 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.902 0 O5'-C5'-C4' 113.132 2.095 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O4'-C4'-C3' 107.41 1.81 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.588 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.15 0 O4'-C4'-C3' 107.848 2.248 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.007 0 O5'-C5'-C4' 113.143 2.102 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C4'-C3' 107.866 2.266 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.834 0 O5'-C5'-C4' 113.191 2.136 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.94 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.042 0 O4'-C4'-C3' 107.777 2.177 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.898 0 O4'-C4'-C3' 107.683 2.083 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.167 0 O4'-C4'-C3' 107.97 2.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.899 ' H6 ' HO5' ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.913 0 O4'-C1'-C2' 108.976 2.615 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.185 0 C4'-C3'-C2' 105.725 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O5'-C5'-C4' 112.839 1.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.522 0 O5'-C5'-C4' 113.803 2.574 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.448 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.427 -1.715 0 O4'-C4'-C3' 107.744 2.144 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.589 ' C7 ' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.529 2.246 0 O4'-C4'-C3' 107.943 2.343 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.721 0 O5'-C5'-C4' 113.374 2.267 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.608 1.539 0 O5'-C5'-C4' 113.465 2.332 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C1'-C2' 108.671 2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.107 0 O4'-C4'-C3' 107.977 2.377 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.153 0 O4'-C4'-C3' 107.484 1.884 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.378 0 O4'-C4'-C3' 107.79 2.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C4'-C3' 107.66 2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.027 0 O4'-C4'-C3' 107.815 2.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.828 0 O4'-C4'-C3' 107.599 1.999 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 44.2 p90 -70.21 150.19 46.71 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.212 -1.17 . . . . 0.0 109.956 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.71 137.67 32.17 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.385 -0.822 . . . . 0.0 109.833 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -55.81 -36.65 67.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.56 -0.712 . . . . 0.0 110.108 -178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -62.91 -42.98 99.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.866 -1.147 . . . . 0.0 109.01 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -55.56 -41.43 73.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.239 -0.913 . . . . 0.0 109.054 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.785 ' O ' HG13 ' A' ' 13' ' ' VAL . 24.9 mm-40 -71.7 -37.23 70.71 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.359 -0.838 . . . . 0.0 109.037 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.34 -51.31 70.36 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.175 -0.953 . . . . 0.0 109.388 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -63.29 -44.37 95.23 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.164 -0.96 . . . . 0.0 109.432 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -66.05 -48.54 70.71 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.881 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.785 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.3 m -69.5 -36.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.727 -1.233 . . . . 0.0 108.603 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -56.7 -39.4 73.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.495 -1.378 . . . . 0.0 107.863 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -58.34 -32.08 68.18 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.456 ' CD1' HD13 ' A' ' 46' ' ' LEU . 8.8 mt -71.35 -40.29 70.78 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.493 -0.755 . . . . 0.0 111.934 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -75.5 -32.92 60.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.452 -1.405 . . . . 0.0 110.119 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.466 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.4 mt-10 -67.08 -26.15 66.58 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.995 -1.066 . . . . 0.0 110.48 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.525 HD13 HH21 ' A' ' 25' ' ' ARG . 34.4 mt -38.36 -41.23 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 121.566 -0.708 . . . . 0.0 110.502 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.443 ' C ' ' OD1' ' A' ' 20' ' ' ASN . 36.5 p30 -172.71 165.65 5.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.873 -1.142 . . . . 0.0 110.309 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -91.1 69.52 6.2 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.663 -0.648 . . . . 0.0 109.63 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -112.19 103.87 55.62 Favored Pre-proline 0 N--CA 1.493 1.695 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -48.62 -42.92 35.19 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.066 1.844 . . . . 0.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -62.54 -38.03 88.44 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.276 -0.89 . . . . 0.0 108.805 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.664 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -60.54 -44.96 95.53 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.481 -0.762 . . . . 0.0 109.874 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.31 -53.87 48.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.226 -0.921 . . . . 0.0 109.729 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tp10 -51.77 -39.76 59.13 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.32 -60.5 3.31 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.425 -0.797 . . . . 0.0 109.933 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' NH1' ' A' ' 25' ' ' ARG . 72.7 mt -54.75 -46.91 74.38 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 109.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.519 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 93.6 m-20 -63.03 -47.34 83.47 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.458 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -67.09 -43.33 82.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.181 -0.949 . . . . 0.0 109.325 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.25 -51.51 69.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.342 -0.849 . . . . 0.0 110.345 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -60.02 -35.29 74.75 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 117.75 -1.58 . . . . 0.0 107.715 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -69.74 -51.48 33.85 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.596 -0.69 . . . . 0.0 110.599 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -59.55 -43.92 93.4 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.245 -0.91 . . . . 0.0 111.92 -178.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 97.0 mtp -57.38 -31.33 65.69 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 111.268 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -54.13 -40.37 67.32 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.493 -1.38 . . . . 0.0 108.553 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -65.99 -40.19 90.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.449 -0.782 . . . . 0.0 109.186 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -63.76 -30.69 71.76 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.632 -0.667 . . . . 0.0 110.194 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.57 1.55 68.43 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 107.914 -2.075 . . . . 0.0 107.914 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.1 p -118.8 84.45 25.42 Favored Pre-proline 0 N--CA 1.487 1.411 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.9 146.08 10.23 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.622 2.214 . . . . 0.0 111.397 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 11.7 mt -79.44 95.22 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 119.126 -1.03 . . . . 0.0 109.454 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.59 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 77.5 m-20 -64.4 -43.55 94.09 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -136.42 133.38 36.61 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.456 HD13 ' CD1' ' A' ' 16' ' ' LEU . 7.3 mt -69.98 132.49 88.49 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 120.777 -1.202 . . . . 0.0 108.714 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -58.99 140.11 93.87 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 N-CA-C 108.82 -1.262 . . . . 0.0 108.82 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.565 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 10.9 mt -106.22 146.02 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.954 -1.091 . . . . 0.0 110.839 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.852 ' SD ' HD13 ' A' ' 54' ' ' LEU . 82.6 mtp -143.54 121.11 11.76 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.18 39.45 1.71 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -178.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt 56.78 22.2 6.73 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.547 0.689 . . . . 0.0 109.576 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.1 m -132.19 150.52 52.14 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.3 m -67.65 146.72 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 120.832 -1.168 . . . . 0.0 108.966 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.852 HD13 ' SD ' ' A' ' 49' ' ' MET . 44.0 tp -74.6 118.06 17.14 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 109.778 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -62.27 93.26 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.327 -0.858 . . . . 0.0 108.95 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -54.09 -26.99 29.98 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 121.054 -1.029 . . . . 0.0 109.405 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -78.88 -59.34 2.82 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.118 -0.988 . . . . 0.0 111.666 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -57.41 -37.6 73.01 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.502 -1.374 . . . . 0.0 109.519 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.684 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.21 -46.66 87.87 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 178.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.479 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 46.2 t80 -61.28 -70.64 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.387 0.613 . . . . 0.0 109.551 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 60' ' ' TYR . 54.3 t30 -38.26 -40.83 0.56 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.657 -0.652 . . . . 0.0 111.01 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.569 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 52.0 mt -72.44 -46.67 53.98 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.356 -1.338 . . . . 0.0 108.277 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 18.9 t -56.37 -43.53 77.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.214 -0.929 . . . . 0.0 110.491 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.479 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 5.8 mm -70.42 -35.22 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.712 -1.243 . . . . 0.0 108.11 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.68 -19.68 17.7 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.765 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.638 HH21 ' CB ' ' A' ' 80' ' ' GLU . 16.3 mmt-85 -94.1 -0.38 55.38 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.735 -1.228 . . . . 0.0 108.234 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.83 14.13 80.16 Favored Glycine 0 N--CA 1.492 2.414 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.609 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.47 ' HA2' HD13 ' A' ' 116' ' ' LEU . . . 147.3 126.21 1.66 Allowed Glycine 0 N--CA 1.5 2.935 0 O-C-N 120.065 -1.844 . . . . 0.0 111.582 178.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.588 HD13 ' CD1' ' A' ' 102' ' ' TYR . 5.6 tp -47.33 -41.01 18.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.492 -1.005 . . . . 0.0 109.956 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.3 t -61.42 -42.19 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.031 -1.043 . . . . 0.0 110.197 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -54.98 -37.53 66.66 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 108.749 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.1 t -65.91 -43.07 93.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.521 -0.737 . . . . 0.0 110.502 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 45.9 mt -66.89 -58.65 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 120.701 -1.249 . . . . 0.0 110.239 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.459 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 96.3 m-20 -58.64 -40.75 84.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.157 -0.964 . . . . 0.0 110.544 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.4 mmtp -92.64 -10.2 38.21 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.157 -0.964 . . . . 0.0 110.614 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 72' ' ' VAL . 49.5 mttp 58.69 56.96 3.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.519 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.46 15.72 10.2 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.837 -1.164 . . . . 0.0 108.12 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.52 ' NE1' HG12 ' A' ' 72' ' ' VAL . 92.9 m95 -65.14 -40.82 94.95 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' NE2' ' OP2' ' C' ' 419' ' ' ' DC' . 97.0 mm-40 -49.06 -38.43 24.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 118.192 -1.403 . . . . 0.0 107.995 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.638 ' CB ' HH21 ' A' ' 66' ' ' ARG . 98.0 mt-10 -69.14 -40.86 77.98 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.498 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.9 mt -71.67 -52.48 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.637 HD11 ' HB2' ' A' ' 95' ' ' ALA . 83.8 mt -51.85 -53.75 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.633 -0.667 . . . . 0.0 110.115 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 79' ' ' GLN . 59.9 mttp -70.88 -37.56 73.02 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.77 -1.206 . . . . 0.0 110.019 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -54.96 -33.7 57.18 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.264 -1.535 . . . . 0.0 109.264 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 77.2 mt -86.7 -10.54 53.48 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.4 -1.059 . . . . 0.0 108.566 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 67.78 40.66 2.37 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 121.34 0.59 . . . . 0.0 110.513 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.72 141.55 79.31 Favored Pre-proline 0 N--CA 1.487 1.405 0 O-C-N 121.157 -0.964 . . . . 0.0 108.634 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.559 ' C ' ' H ' ' A' ' 90' ' ' SER . 39.8 Cg_endo -71.59 142.03 39.31 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 121.979 1.786 . . . . 0.0 112.076 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 91.0 p -55.73 0.01 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.559 ' H ' ' C ' ' A' ' 88' ' ' PRO . 20.4 m -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.077 -1.015 . . . . 0.0 109.937 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.3 mt -92.86 101.57 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 120.781 -1.199 . . . . 0.0 109.258 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -71.26 -29.53 65.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.226 -0.921 . . . . 0.0 109.179 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.407 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 50.3 m -96.32 40.07 1.14 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.46 -0.775 . . . . 0.0 109.472 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -62.6 1.51 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.945 . . . . 0.0 108.721 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.637 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.6 -51.06 22.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.289 -0.882 . . . . 0.0 109.694 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.531 HD22 ' C7 ' ' C' ' 421' ' ' ' DT' . 7.1 tp -58.53 -41.22 85.0 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.603 -1.31 . . . . 0.0 108.61 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.623 HG22 HE22 ' A' ' 101' ' ' GLN . 35.8 m -63.87 -41.31 97.78 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.272 -0.893 . . . . 0.0 109.271 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.423 HD22 HD13 ' A' ' 59' ' ' LEU . 9.2 mt -68.49 -46.35 69.92 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.266 -0.896 . . . . 0.0 110.692 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.752 ' NH1' HD21 ' A' ' 129' ' ' ASN . 34.6 ttp180 -68.17 -48.57 64.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.137 -0.977 . . . . 0.0 110.833 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.9 m -55.54 -53.54 55.13 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.058 -1.026 . . . . 0.0 110.017 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.623 HE22 HG22 ' A' ' 97' ' ' THR . 8.4 mt-30 -64.68 -41.19 96.23 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.954 -1.091 . . . . 0.0 111.548 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.3 t80 -57.23 -41.98 80.56 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 120.317 -1.489 . . . . 0.0 109.007 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.697 ' HG2' HD21 ' A' ' 122' ' ' LEU . 83.1 mtp -54.24 -57.69 10.23 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-O 121.471 0.653 . . . . 0.0 112.246 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -71.17 -51.47 24.67 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.414 -1.429 . . . . 0.0 112.099 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' HD12 ' A' ' 106' ' ' LEU . 60.6 m-85 -84.67 -46.14 11.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -175.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.653 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.9 mp -103.13 11.97 36.41 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.355 -1.466 . . . . 0.0 113.835 -176.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.541 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 67.5 t80 -68.79 -38.4 11.65 Favored Pre-proline 0 N--CA 1.495 1.801 0 O-C-N 119.903 -1.748 . . . . 0.0 111.492 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.541 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 86.9 Cg_endo -79.1 -41.57 0.22 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 121.535 1.49 . . . . 0.0 112.514 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -58.47 -41.92 86.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.856 -1.152 . . . . 0.0 107.975 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.492 ' CG ' HD12 ' A' ' 116' ' ' LEU . 61.3 tt0 -70.65 -49.58 45.9 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.443 0.64 . . . . 0.0 110.213 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.516 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.5 t -74.82 -44.43 49.33 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.379 -0.826 . . . . 0.0 110.675 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.0 tp10 -66.4 -46.05 77.93 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.347 -0.846 . . . . 0.0 111.061 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -75.08 -33.2 61.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.039 -1.038 . . . . 0.0 111.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.02 -25.18 3.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.844 -1.16 . . . . 0.0 112.133 -177.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.0 t-20 59.26 50.7 7.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.579 -1.326 . . . . 0.0 110.506 178.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.492 HD12 ' CG ' ' A' ' 110' ' ' GLU . 26.2 mt -68.37 -32.17 72.06 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.346 -0.847 . . . . 0.0 111.839 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 10.0 t -154.66 -167.02 2.48 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 118.465 -1.294 . . . . 0.0 111.502 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 67.7 p -123.77 160.3 52.02 Favored Pre-proline 0 N--CA 1.497 1.877 0 O-C-N 121.771 -0.58 . . . . 0.0 109.574 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -59.98 -38.69 76.75 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.348 1.365 . . . . 0.0 112.007 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.6 -37.56 86.71 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.987 -1.071 . . . . 0.0 109.561 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.25 -48.37 67.95 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.697 HD21 ' HG2' ' A' ' 103' ' ' MET . 39.8 tp -63.22 -53.2 56.85 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.486 -0.759 . . . . 0.0 109.92 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -57.76 -44.33 86.09 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.002 -1.061 . . . . 0.0 109.235 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.18 91.07 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.518 -0.738 . . . . 0.0 111.074 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.459 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -69.2 -32.08 71.12 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.027 -1.046 . . . . 0.0 109.17 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.684 ' CG2' ' NH2' ' A' ' 130' ' ' ARG . 12.0 mt -63.58 -49.42 82.52 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.001 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.17 -35.93 78.82 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -66.45 -17.9 67.04 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.752 HD21 ' NH1' ' A' ' 99' ' ' ARG . 17.2 p-10 -94.3 -30.58 14.46 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.842 -1.387 . . . . 0.0 110.644 -179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.684 ' NH2' ' CG2' ' A' ' 126' ' ' ILE . 1.1 mtt-85 -61.73 145.82 51.23 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.65 -1.281 . . . . 0.0 110.112 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.543 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.7 mpt_? -69.41 149.13 48.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.526 -0.734 . . . . 0.0 109.299 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -76.39 1.39 16.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.161 -0.962 . . . . 0.0 110.132 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.408 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.426 -1.812 0 O4'-C1'-C2' 107.865 1.605 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.587 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.613 1.983 0 O4'-C1'-C2' 108.737 2.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.951 0 O4'-C4'-C3' 107.554 1.954 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O5'-C5'-C4' 113.318 2.227 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O5'-C5'-C4' 113.297 2.212 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.77 0 O5'-C5'-C4' 113.043 2.03 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.755 0 O4'-C4'-C3' 107.367 1.767 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.565 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.181 0 O4'-C4'-C3' 107.849 2.249 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . 0.5 ' C5 ' ' N6 ' ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.003 0 O5'-C5'-C4' 113.01 2.007 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.5 ' N6 ' ' C5 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.327 0 O4'-C4'-C3' 107.985 2.385 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.872 0 O5'-C5'-C4' 113.055 2.039 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O5'-C5'-C4' 113.475 2.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.798 0 O4'-C4'-C3' 107.978 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.857 0 O4'-C4'-C3' 107.398 1.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.224 0 O4'-C4'-C3' 107.893 2.293 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.47 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.261 0 O4'-C1'-C2' 107.71 1.463 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.47 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C4'-C3' 107.954 2.354 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.465 ' C2 ' ' C2 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.61 1.668 0 O4'-C4'-C3' 107.2 1.6 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.465 ' C2 ' ' C2 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.606 1.302 0 O5'-C5'-C4' 113.7 2.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.58 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.427 -1.716 0 O4'-C4'-C3' 107.786 2.186 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.531 ' C7 ' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 P--O5' 1.61 1.718 0 O4'-C4'-C3' 107.789 2.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.576 0 O5'-C5'-C4' 113.045 2.032 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.005 0 O5'-C5'-C4' 113.365 2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.988 0 C4'-C3'-C2' 105.628 2.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.841 0 O4'-C4'-C3' 108.085 2.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C4'-C3' 107.629 2.029 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.159 0 O4'-C4'-C3' 107.922 2.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.73 0 O4'-C4'-C3' 107.733 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C4'-C3' 107.912 2.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C4'-C3' 107.601 2.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.335 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 68.0 t90 -114.23 75.88 0.95 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 109.525 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.4 p -114.2 145.53 41.57 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.263 -0.898 . . . . 0.0 109.65 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -54.85 -38.27 67.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.456 -0.777 . . . . 0.0 110.219 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.5 -45.69 91.84 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.794 -1.191 . . . . 0.0 109.643 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -60.26 -40.87 91.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 109.619 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.969 ' O ' HG12 ' A' ' 13' ' ' VAL . 20.5 mm-40 -68.91 -42.73 76.44 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.432 -0.792 . . . . 0.0 110.046 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.02 -46.67 84.91 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.291 -0.881 . . . . 0.0 109.826 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -62.27 -43.69 98.25 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.009 -1.057 . . . . 0.0 109.54 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -65.91 -50.21 65.25 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.457 -0.777 . . . . 0.0 111.09 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.969 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.2 p -68.15 -39.02 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 120.705 -1.247 . . . . 0.0 109.455 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -61.52 -38.35 87.06 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.274 -1.516 . . . . 0.0 107.757 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.422 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.0 OUTLIER -56.22 -32.41 64.42 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.085 -1.046 . . . . 0.0 108.179 178.249 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.483 ' HB3' HD13 ' A' ' 29' ' ' LEU . 6.5 mt -66.85 -41.2 87.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.316 -0.865 . . . . 0.0 111.734 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -75.7 -36.59 59.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.363 -1.461 . . . . 0.0 109.88 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -70.3 -3.86 19.27 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.072 -1.018 . . . . 0.0 110.97 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.652 HG21 ' NH1' ' A' ' 25' ' ' ARG . 8.9 mt -56.66 -41.42 74.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 O-C-N 121.236 -0.915 . . . . 0.0 109.467 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -171.85 166.41 6.43 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.058 -1.026 . . . . 0.0 110.397 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.496 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 50.9 p30 -89.22 67.27 7.86 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.641 -0.662 . . . . 0.0 110.835 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.43 ' C ' ' OD1' ' A' ' 22' ' ' ASP . 8.8 t0 -112.17 95.41 30.15 Favored Pre-proline 0 N--CA 1.493 1.682 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.12 -41.65 33.65 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 122.207 1.938 . . . . 0.0 112.794 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -62.56 -40.03 95.55 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 120.908 -1.12 . . . . 0.0 108.752 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.652 ' NH1' HG21 ' A' ' 19' ' ' ILE . 63.1 ttt180 -59.69 -36.12 75.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 110.11 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -60.15 -52.94 63.17 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.403 -0.811 . . . . 0.0 109.354 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -52.65 -38.3 60.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.471 -0.768 . . . . 0.0 109.971 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -64.48 -59.74 3.97 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.081 -1.012 . . . . 0.0 110.81 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.483 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.7 mt -52.93 -47.91 67.7 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.041 -1.037 . . . . 0.0 108.791 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -61.93 -45.14 95.01 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.418 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.1 -46.73 73.33 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.218 -0.926 . . . . 0.0 109.843 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.5 tp -57.21 -47.78 80.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.224 -0.922 . . . . 0.0 110.276 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.517 ' CE2' HG23 ' A' ' 13' ' ' VAL . 47.7 m-85 -61.89 -36.6 81.78 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.19 -1.404 . . . . 0.0 107.679 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -70.24 -53.12 18.31 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.564 -0.71 . . . . 0.0 109.975 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.4 ' CE2' ' HD3' ' A' ' 39' ' ' ARG . 74.6 t80 -59.2 -42.08 90.06 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.375 -0.828 . . . . 0.0 111.172 -178.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mmm -57.23 -34.85 68.98 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.189 -0.944 . . . . 0.0 110.443 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -54.63 -39.92 68.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 109.362 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -74.89 -30.21 61.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 108.793 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 35' ' ' PHE . 14.6 mmm180 -65.72 -30.85 71.58 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.742 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 92.93 -0.63 69.78 Favored Glycine 0 N--CA 1.484 1.875 0 N-CA-C 107.378 -2.289 . . . . 0.0 107.378 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.5 p -116.68 84.48 15.4 Favored Pre-proline 0 N--CA 1.488 1.468 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -83.14 139.03 9.25 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 122.558 2.172 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.9 mt -73.75 96.76 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.091 -1.005 . . . . 0.0 110.246 -178.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 81.9 m-20 -60.52 -33.99 73.44 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -158.98 139.24 12.24 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.462 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.92 125.37 92.0 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.032 -1.043 . . . . 0.0 110.157 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -53.21 139.52 62.99 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 N-CA-C 108.173 -1.51 . . . . 0.0 108.173 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.576 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 8.7 mt -103.11 146.7 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 120.867 -1.146 . . . . 0.0 110.714 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 73.2 mmm -137.41 127.06 25.27 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 56.85 42.89 25.83 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.93 24.51 12.64 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.365 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -135.05 153.84 51.92 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.182 -0.949 . . . . 0.0 109.324 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.2 m -67.27 142.09 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 120.983 -1.073 . . . . 0.0 109.387 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 HD22 ' A' ' 59' ' ' LEU . 64.8 tp -75.16 123.48 25.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.307 -0.871 . . . . 0.0 110.012 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.595 ' CG ' HH22 ' A' ' 25' ' ' ARG . 38.5 m-20 -59.56 99.96 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.521 -0.737 . . . . 0.0 109.719 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.6 -30.32 71.25 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.074 -1.016 . . . . 0.0 109.234 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -80.85 -60.56 2.26 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.291 -0.881 . . . . 0.0 111.578 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -54.1 -38.16 65.07 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.666 -1.271 . . . . 0.0 108.584 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.639 HD22 HD21 ' A' ' 54' ' ' LEU . 65.6 tp -59.95 -46.37 89.64 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.441 ' CE2' HG13 ' A' ' 64' ' ' ILE . 54.0 t80 -59.37 -66.38 0.52 Allowed 'General case' 0 C--N 1.298 -1.661 0 CA-C-O 121.485 0.659 . . . . 0.0 109.731 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -42.92 -42.11 3.59 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.582 -0.699 . . . . 0.0 111.552 -178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.99 -43.63 64.78 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.059 -1.456 . . . . 0.0 108.066 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.765 HG21 ' CE2' ' A' ' 102' ' ' TYR . 36.1 t -58.98 -44.35 90.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 O-C-N 121.239 -0.913 . . . . 0.0 109.334 179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.441 HG13 ' CE2' ' A' ' 60' ' ' TYR . 15.7 mm -69.55 -38.72 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 120.738 -1.226 . . . . 0.0 108.403 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.89 -19.93 7.7 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.812 -0.555 . . . . 0.0 110.13 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.553 ' CG ' HD13 ' A' ' 77' ' ' LEU . 7.0 mpt_? -95.06 -0.82 53.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.584 -1.323 . . . . 0.0 108.957 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.63 72.56 Favored Glycine 0 N--CA 1.492 2.404 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.263 177.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.1 131.52 2.46 Favored Glycine 0 N--CA 1.498 2.806 0 CA-C-N 119.722 1.761 . . . . 0.0 111.703 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.485 HD11 ' CH2' ' A' ' 78' ' ' TRP . 20.1 tp -52.64 -38.97 61.27 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.678 -0.895 . . . . 0.0 109.738 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 77.8 t -56.15 -43.64 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.202 -0.936 . . . . 0.0 108.97 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -59.15 -40.2 84.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.166 -0.959 . . . . 0.0 110.025 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.595 ' O ' ' N ' ' A' ' 76' ' ' LYS . 60.5 t -63.64 -43.99 98.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.53 0 O-C-N 120.741 -1.224 . . . . 0.0 109.551 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 33.7 mt -65.04 -61.53 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 120.758 -1.214 . . . . 0.0 110.182 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -58.48 -41.38 85.17 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.156 -0.965 . . . . 0.0 110.764 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -10.03 44.13 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.95 -1.093 . . . . 0.0 110.261 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' VAL . 21.4 mtmm 58.69 60.66 2.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.29 -0.881 . . . . 0.0 110.951 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.553 HD13 ' CG ' ' A' ' 66' ' ' ARG . 13.0 mt -95.42 14.22 23.32 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.104 -0.998 . . . . 0.0 108.55 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' A' ' 82' ' ' ILE . 98.8 m95 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.36 -0.837 . . . . 0.0 109.03 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.445 ' C ' ' O ' ' A' ' 78' ' ' TRP . 80.5 mt-30 -48.13 -38.83 18.77 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.537 -1.352 . . . . 0.0 108.437 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 84' ' ' GLY . 78.8 mm-40 -67.85 -38.61 83.35 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 178.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' TRP . 4.3 mt -74.25 -51.41 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.68 HD11 ' HB2' ' A' ' 95' ' ' ALA . 57.3 mt -52.0 -56.05 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.49 -37.07 68.53 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.374 -0.829 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -51.85 -34.7 37.96 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 84.7 mt -91.49 -4.92 55.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.373 -1.075 . . . . 0.0 109.039 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 65.72 38.98 5.01 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.642 0.734 . . . . 0.0 109.16 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.24 145.75 86.03 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.411 ' C ' ' H ' ' A' ' 90' ' ' SER . 37.0 Cg_endo -71.06 136.68 30.11 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.281 1.987 . . . . 0.0 112.415 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 t -62.79 -0.7 0.7 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 88' ' ' PRO . 77.9 p -64.64 -25.56 68.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.987 -1.07 . . . . 0.0 109.551 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.5 mt -93.25 99.5 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.99 -1.069 . . . . 0.0 108.748 178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 40.8 p -68.35 -31.12 70.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.108 -0.995 . . . . 0.0 108.851 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.472 ' OG ' ' O4 ' ' C' ' 421' ' ' ' DT' . 58.4 m -88.07 29.25 0.96 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.23 -67.35 0.38 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.4 -0.813 . . . . 0.0 108.976 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.03 -47.54 33.51 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.644 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.477 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 5.5 tp -59.8 -45.53 92.06 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.33 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 36.2 m -61.63 -39.75 92.41 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.02 -1.05 . . . . 0.0 108.616 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.8 mt -70.9 -43.99 67.19 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.509 -0.745 . . . . 0.0 109.725 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HA ' ' CH2' ' A' ' 78' ' ' TRP . 3.6 tmm_? -66.24 -51.28 59.09 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.111 -0.993 . . . . 0.0 110.66 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.2 m -57.11 -54.69 43.91 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.552 -0.718 . . . . 0.0 110.996 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -62.61 -41.2 98.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.986 -1.071 . . . . 0.0 111.393 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.765 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.9 t80 -57.32 -41.63 80.29 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.545 -1.347 . . . . 0.0 109.344 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.712 ' CE ' HD11 ' A' ' 126' ' ' ILE . 35.3 ttm -53.81 -52.89 58.88 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.823 -0.548 . . . . 0.0 111.313 -178.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -71.17 -54.84 9.62 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.811 -1.181 . . . . 0.0 112.732 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.467 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -84.86 -45.8 11.94 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -174.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.646 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.4 mp -97.4 -7.74 31.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.121 -1.612 . . . . 0.0 114.255 -175.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.634 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 26.6 t80 -57.94 -38.3 65.2 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 119.822 -1.799 . . . . 0.0 110.006 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 24.4 Cg_exo -65.0 -54.43 0.66 Allowed 'Trans proline' 0 N--CA 1.5 1.881 0 C-N-CA 122.513 2.142 . . . . 0.0 112.793 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.23 -44.07 88.04 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.178 -0.951 . . . . 0.0 108.64 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -66.33 -53.95 30.4 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 110.502 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.634 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 58.0 m -71.62 -45.09 63.11 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -0.868 . . . . 0.0 111.456 -177.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.0 tp10 -67.67 -49.44 62.82 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.912 -1.117 . . . . 0.0 111.268 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -76.76 -23.79 52.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.995 -1.065 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.419 ' HG2' HD21 ' A' ' 116' ' ' LEU . 15.1 tptp -125.88 -30.96 2.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.81 -1.181 . . . . 0.0 111.416 -177.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 111' ' ' CYS . 15.3 t30 56.32 47.02 19.96 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.92 -1.113 . . . . 0.0 110.226 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.419 HD21 ' HG2' ' A' ' 114' ' ' LYS . 48.5 mt -67.64 -30.28 69.8 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.003 -1.06 . . . . 0.0 111.114 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 32.1 t -153.94 -166.64 2.43 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.371 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 64.0 p -126.79 153.66 75.92 Favored Pre-proline 0 N--CA 1.497 1.903 0 O-C-N 121.711 -0.618 . . . . 0.0 109.984 -178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -52.08 -40.54 68.05 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 122.121 1.881 . . . . 0.0 112.188 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.27 89.35 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.769 -1.207 . . . . 0.0 109.727 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -65.84 -42.94 89.86 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.6 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.1 tp -65.69 -53.59 38.92 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.576 -0.702 . . . . 0.0 109.937 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.629 ' HA ' HD12 ' A' ' 126' ' ' ILE . 68.3 tp60 -56.05 -44.37 78.78 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.55 75.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 178.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -70.54 -36.12 73.51 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.752 0.786 . . . . 0.0 108.954 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.712 HD11 ' CE ' ' A' ' 103' ' ' MET . 34.0 mt -59.05 -52.89 55.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.1 m-20 -67.0 -37.7 84.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.509 -0.744 . . . . 0.0 109.327 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.15 -30.11 72.89 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.698 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -95.82 -36.36 11.16 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.916 -1.344 . . . . 0.0 110.505 -178.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.698 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.7 mtp180 -63.84 145.38 55.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.85 -1.156 . . . . 0.0 110.295 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.578 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -66.21 144.83 56.39 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.655 -0.653 . . . . 0.0 109.334 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -108.43 -153.6 0.51 Allowed 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.343 -0.848 . . . . 0.0 108.807 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.686 -1.365 . . . . 0.0 109.686 -179.952 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.408 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -2.002 0 O4'-C1'-C2' 108.188 1.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.557 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 P--O5' 1.612 1.927 0 O4'-C1'-C2' 108.698 2.362 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.957 0 O4'-C4'-C3' 107.631 2.031 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.487 0 O4'-C4'-C3' 107.856 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O5'-C5'-C4' 113.197 2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.029 0 O5'-C5'-C4' 113.126 2.09 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.887 0 O5'-C5'-C4' 112.811 1.865 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.576 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.203 0 O4'-C4'-C3' 107.75 2.15 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.981 0 O4'-C4'-C3' 107.679 2.079 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.917 0 O4'-C1'-C2' 108.705 2.368 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O5'-C5'-C4' 113.125 2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.223 0 O5'-C5'-C4' 113.468 2.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.689 0 O5'-C5'-C4' 113.031 2.022 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C4'-C3' 107.385 1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.972 2.372 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.466 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.419 -2.424 0 O4'-C1'-C2' 107.558 1.325 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.466 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O4'-C1'-C2' 108.702 2.365 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.44 " H4'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.529 2.198 0 O5'-C5'-C4' 112.576 1.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.41 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.629 0 C4'-C3'-C2' 105.618 2.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.57 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C4'-C3' 107.843 2.243 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.477 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.121 0 O4'-C4'-C3' 107.725 2.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.019 0 O5'-C5'-C4' 113.438 2.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.929 0 O5'-C5'-C4' 113.386 2.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.826 0 O4'-C1'-C2' 108.777 2.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C4'-C3' 108.052 2.452 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.905 0 O4'-C4'-C3' 107.887 2.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.391 0 O4'-C4'-C3' 107.929 2.329 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.739 0 O4'-C4'-C3' 107.793 2.193 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.777 0 O4'-C4'-C3' 107.781 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C4'-C3' 107.703 2.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -113.9 78.93 1.19 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.419 -1.047 . . . . 0.0 108.71 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -109.62 140.92 42.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.534 -0.729 . . . . 0.0 109.987 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 6' ' ' PHE . 0.0 OUTLIER -57.28 -43.01 82.76 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.439 -0.788 . . . . 0.0 109.474 -179.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.41 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 95.1 mt-10 -63.32 -45.78 89.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.012 -1.055 . . . . 0.0 109.208 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -56.76 -39.94 74.94 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 108.615 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.888 ' O ' HG12 ' A' ' 13' ' ' VAL . 20.0 mm-40 -69.14 -37.78 78.48 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.483 -0.76 . . . . 0.0 109.038 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -55.15 -49.4 71.92 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.363 -0.836 . . . . 0.0 109.62 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -61.6 -38.73 88.68 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.92 -1.113 . . . . 0.0 109.176 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -65.21 -52.56 53.94 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.482 -0.761 . . . . 0.0 111.13 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.888 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -70.53 -35.95 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.989 -1.069 . . . . 0.0 109.62 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -60.05 -38.73 83.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.305 -1.497 . . . . 0.0 107.894 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.433 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.4 OUTLIER -58.93 -31.87 69.05 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 178.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 19' ' ' ILE . 11.9 mt -67.44 -36.41 81.16 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.436 -0.79 . . . . 0.0 110.964 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.417 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 81.5 m-85 -82.32 -38.62 24.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.375 -1.453 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.6 -30.25 71.28 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.067 -1.021 . . . . 0.0 111.032 -177.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 16' ' ' LEU . 8.1 mt -38.02 -37.08 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 O-C-N 121.567 -0.708 . . . . 0.0 110.363 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.3 m120 -170.31 159.68 7.32 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.952 -1.093 . . . . 0.0 109.78 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -92.2 64.82 4.56 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.736 -0.603 . . . . 0.0 109.525 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.94 137.55 20.15 Favored Pre-proline 0 N--CA 1.49 1.554 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -71.81 -61.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 122.029 1.819 . . . . 0.0 112.198 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -59.35 -37.84 78.89 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.224 -0.923 . . . . 0.0 109.649 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.482 ' NH2' HG21 ' A' ' 19' ' ' ILE . 57.0 ttt180 -56.84 -42.39 79.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.646 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -60.9 -54.23 47.65 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.154 -0.966 . . . . 0.0 108.834 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -53.42 -36.17 61.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.591 -0.693 . . . . 0.0 109.633 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -61.42 -62.91 1.49 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.344 -0.847 . . . . 0.0 110.816 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.632 HD22 HD13 ' A' ' 16' ' ' LEU . 16.4 mt -57.13 -44.45 83.36 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.515 -0.741 . . . . 0.0 109.55 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.417 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 30.6 m-20 -63.4 -45.9 88.9 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.352 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -66.43 -42.37 87.82 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.114 -0.991 . . . . 0.0 109.008 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.97 -50.51 73.15 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.322 -0.861 . . . . 0.0 110.169 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -60.83 -34.08 74.01 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 117.988 -1.485 . . . . 0.0 107.971 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.5 m -68.88 -50.16 52.06 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.092 -1.005 . . . . 0.0 108.942 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -60.1 -43.27 95.7 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 111.103 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.7 mmm -58.22 -35.79 72.18 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.229 -0.92 . . . . 0.0 110.84 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -59.19 -40.33 85.39 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.695 -1.253 . . . . 0.0 108.853 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -64.73 -40.91 96.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.332 -0.855 . . . . 0.0 109.396 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB2' ' A' ' 108' ' ' PRO . 0.0 OUTLIER -65.2 -30.11 70.98 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.898 -0.501 . . . . 0.0 110.412 -178.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.37 1.13 64.63 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 107.775 -2.13 . . . . 0.0 107.775 -178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.4 p -116.56 85.23 16.22 Favored Pre-proline 0 N--CA 1.488 1.434 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -83.53 148.47 12.72 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.733 2.289 . . . . 0.0 111.716 -179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.53 HG21 HD23 ' A' ' 46' ' ' LEU . 46.0 mt -87.52 101.42 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.037 -1.039 . . . . 0.0 110.195 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.562 ' C ' ' NE2' ' A' ' 9' ' ' GLN . 84.9 m-20 -85.95 -0.77 56.31 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.311 -0.868 . . . . 0.0 109.026 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.6 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.0 OUTLIER -171.79 120.23 0.46 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.507 -0.745 . . . . 0.0 109.206 -179.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.53 HD23 HG21 ' A' ' 43' ' ' ILE . 14.0 mt -72.09 118.9 71.21 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.054 -1.029 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.438 ' HB3' ' NE2' ' A' ' 101' ' ' GLN . 48.3 Cg_exo -49.72 128.29 20.94 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 N-CA-C 108.831 -1.257 . . . . 0.0 108.831 177.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.608 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 60.4 mt -95.71 144.19 10.59 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.134 -0.979 . . . . 0.0 110.608 -177.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.71 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.4 mtp -135.09 122.1 21.26 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.87 39.83 3.27 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -178.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 58.6 24.4 12.0 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.252 0.549 . . . . 0.0 110.247 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.502 ' N ' HG23 ' A' ' 48' ' ' ILE . 78.2 p -136.64 152.75 50.77 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.189 -0.945 . . . . 0.0 109.445 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.9 m -67.39 144.99 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 120.973 -1.079 . . . . 0.0 109.216 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.71 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.3 tp -74.16 120.49 19.81 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 110.028 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -63.05 91.8 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.341 -0.85 . . . . 0.0 109.09 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.06 -26.22 59.99 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.145 -0.972 . . . . 0.0 110.096 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.444 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 44.3 t80 -81.02 -57.03 3.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.066 -1.021 . . . . 0.0 111.586 -178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.43 -37.87 79.21 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.564 -1.335 . . . . 0.0 109.411 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.629 HD22 HD21 ' A' ' 54' ' ' LEU . 65.3 tp -59.83 -45.99 90.65 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.413 ' CE2' HG13 ' A' ' 64' ' ' ILE . 43.3 t80 -57.26 -66.64 0.42 Allowed 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.522 0.677 . . . . 0.0 109.41 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 74.6 m-20 -41.43 -41.13 1.94 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.689 -0.632 . . . . 0.0 111.219 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.44 -43.14 64.2 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 118.234 -1.386 . . . . 0.0 107.689 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 43.7 t -59.39 -44.75 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.874 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.413 HG13 ' CE2' ' A' ' 60' ' ' TYR . 8.6 mm -69.51 -36.86 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 120.663 -1.273 . . . . 0.0 108.318 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.403 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.1 -22.81 11.88 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.848 -0.533 . . . . 0.0 110.27 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.517 ' CG ' HD13 ' A' ' 77' ' ' LEU . 9.0 mpt_? -92.93 -0.22 57.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.614 -1.304 . . . . 0.0 108.753 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.98 17.99 68.55 Favored Glycine 0 N--CA 1.49 2.252 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.818 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 141.24 129.38 2.48 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 120.548 -1.56 . . . . 0.0 111.259 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.55 HD11 ' CH2' ' A' ' 78' ' ' TRP . 15.6 tp -50.36 -40.64 49.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.677 -0.896 . . . . 0.0 110.361 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.2 t -57.75 -42.14 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.861 -1.149 . . . . 0.0 109.871 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -55.94 -40.12 72.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.914 -1.116 . . . . 0.0 108.909 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 94.0 t -65.06 -41.29 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 110.157 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.47 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 49.3 mt -67.59 -56.66 12.39 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 O-C-N 120.775 -1.203 . . . . 0.0 109.734 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -57.69 -42.03 82.84 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.136 -0.977 . . . . 0.0 110.184 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -92.23 -10.21 39.38 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.253 -0.904 . . . . 0.0 110.452 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 3.5 mtmp? 58.54 59.08 3.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.385 -0.822 . . . . 0.0 110.05 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 15.37 11.46 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.014 -1.054 . . . . 0.0 108.545 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.734 ' HE1' HH12 ' A' ' 99' ' ' ARG . 99.0 m95 -63.26 -37.56 87.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 108.923 178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.548 ' NE2' ' H ' ' A' ' 79' ' ' GLN . 3.6 mp0 -48.9 -40.82 31.35 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.439 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HB3' HH21 ' A' ' 66' ' ' ARG . 81.3 mm-40 -69.05 -38.85 79.34 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt -71.28 -53.46 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 178.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.718 HD11 ' HB2' ' A' ' 95' ' ' ALA . 76.3 mt -53.19 -52.83 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -73.58 -40.29 64.0 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.292 -0.88 . . . . 0.0 109.889 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.05 -34.18 46.06 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' C ' ' CD2' ' A' ' 86' ' ' HIS . 87.7 mt -88.48 -7.2 56.94 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.287 -1.125 . . . . 0.0 108.886 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.448 ' CD2' ' C ' ' A' ' 85' ' ' LEU . 12.8 m-70 69.15 36.67 2.34 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-O 121.576 0.703 . . . . 0.0 109.245 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -73.3 121.01 84.06 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.359 -0.838 . . . . 0.0 109.198 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 90' ' ' SER . 45.9 Cg_exo -50.08 139.62 34.06 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 121.669 1.579 . . . . 0.0 112.23 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 p -63.44 0.87 0.62 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 109.619 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 88' ' ' PRO . 89.1 p -65.04 -24.49 67.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.935 -178.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 50' ' ' ALA . 86.6 mt -95.72 98.43 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.948 -1.095 . . . . 0.0 108.894 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 30.6 p -68.36 -28.51 67.19 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -0.92 . . . . 0.0 108.803 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.8 m -90.5 30.54 1.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.26 -65.9 0.62 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.333 -0.855 . . . . 0.0 108.986 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.718 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.92 -50.7 33.95 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 109.179 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.03 -45.66 86.6 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.851 -1.156 . . . . 0.0 108.978 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 23.9 m -60.67 -40.02 90.56 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.174 -0.954 . . . . 0.0 108.845 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.5 mt -72.56 -44.49 62.02 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.452 -0.78 . . . . 0.0 110.152 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.734 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.6 ttm-85 -65.99 -52.86 45.65 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.176 -0.953 . . . . 0.0 110.739 -179.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.1 m -57.05 -52.73 64.11 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.43 -0.794 . . . . 0.0 110.778 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.438 ' NE2' ' HB3' ' A' ' 47' ' ' PRO . 86.6 mt-30 -62.34 -40.67 97.13 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.127 -0.983 . . . . 0.0 111.142 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.4 t80 -57.92 -39.49 78.1 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 120.55 -1.344 . . . . 0.0 109.038 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.538 ' HG3' HD21 ' A' ' 122' ' ' LEU . 2.9 ttm -53.96 -56.49 17.34 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.548 -0.72 . . . . 0.0 111.877 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.8 mttt -72.42 -52.18 17.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.479 -1.388 . . . . 0.0 113.032 -176.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.428 ' C ' HD12 ' A' ' 106' ' ' LEU . 62.6 m-85 -85.33 -50.96 6.9 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.629 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -96.52 6.05 49.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.338 -1.476 . . . . 0.0 113.751 -176.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.598 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 78.0 t80 -68.42 -37.15 9.83 Favored Pre-proline 0 C--N 1.3 -1.545 0 O-C-N 120.013 -1.68 . . . . 0.0 111.666 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.1 Cg_endo -80.28 -39.52 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.315 0 C-N-CA 121.333 1.356 . . . . 0.0 111.688 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -59.47 -39.84 84.99 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -72.68 -53.91 10.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.482 -0.761 . . . . 0.0 109.909 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.59 ' O ' ' N ' ' A' ' 115' ' ' ASN . 2.8 t -70.56 -44.25 67.81 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.294 -0.879 . . . . 0.0 110.739 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.447 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 43.3 tp10 -66.79 -47.87 70.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 120.759 -1.213 . . . . 0.0 110.851 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -75.97 -28.17 57.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.054 -1.029 . . . . 0.0 111.158 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HG2' HD21 ' A' ' 116' ' ' LEU . 44.3 tptt -125.32 -26.55 3.6 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.064 -1.022 . . . . 0.0 111.811 -177.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.59 ' N ' ' O ' ' A' ' 111' ' ' CYS . 0.5 OUTLIER 57.72 45.67 18.5 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.644 -1.285 . . . . 0.0 110.048 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.462 HD21 ' HG2' ' A' ' 114' ' ' LYS . 75.6 mt -68.4 -32.61 72.79 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.203 -0.935 . . . . 0.0 110.958 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.505 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 42.9 t -155.79 -166.93 2.34 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.633 -1.227 . . . . 0.0 111.94 -178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.456 ' C ' ' OH ' ' A' ' 107' ' ' TYR . 70.5 p -120.55 153.65 56.53 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -179.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.598 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 14.7 Cg_endo -59.35 -38.17 86.09 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 121.876 1.717 . . . . 0.0 112.186 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.07 85.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.051 -1.031 . . . . 0.0 109.319 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.505 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 97.9 mt-10 -66.81 -42.73 85.4 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.538 HD21 ' HG3' ' A' ' 103' ' ' MET . 11.5 tp -64.74 -52.85 54.87 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 109.431 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -57.89 -46.43 84.92 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.201 -0.937 . . . . 0.0 109.065 178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.8 -42.72 98.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.38 -0.825 . . . . 0.0 110.152 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.53 73.42 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.061 -1.024 . . . . 0.0 108.342 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 4.1 mt -65.47 -49.25 79.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 130' ' ' ARG . 89.8 m-20 -61.09 -38.3 85.78 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.66 -30.87 78.1 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.702 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.0 OUTLIER -90.59 -34.28 15.55 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.981 -1.305 . . . . 0.0 110.902 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.66 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 67.6 mtm180 -61.6 149.85 37.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.625 -1.297 . . . . 0.0 109.513 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.559 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -69.53 137.62 52.63 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.513 -0.742 . . . . 0.0 109.749 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -85.49 0.61 51.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.868 . . . . 0.0 108.958 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.999 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.024 0 O4'-C1'-C2' 108.344 2.04 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.523 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.226 0 O4'-C1'-C2' 108.711 2.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.855 0 O4'-C4'-C3' 107.563 1.963 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.93 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.197 0 O4'-C4'-C3' 107.536 1.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.154 0 O5'-C5'-C4' 113.196 2.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . 0.551 ' OP2' ' NH2' ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.812 0 O4'-C4'-C3' 107.618 2.018 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.608 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.608 1.464 0 O4'-C1'-C2' 108.515 2.196 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.981 0 O5'-C5'-C4' 112.915 1.939 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.414 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 P--O5' 1.613 2.009 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.414 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.674 0 O5'-C5'-C4' 113.267 2.191 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.748 0 O4'-C4'-C3' 107.834 2.234 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.696 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.852 0 O5'-C5'-C4' 112.629 1.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.862 0 O4'-C4'-C3' 107.899 2.299 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.455 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -2.009 0 O4'-C1'-C2' 107.794 1.54 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.455 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.14 0 O4'-C1'-C2' 108.785 2.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.275 0 O5'-C5'-C4' 112.538 1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.411 ' OP1' ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 P--O5' 1.609 1.559 0 O5'-C5'-C4' 113.621 2.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.573 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.866 0 O4'-C4'-C3' 107.833 2.233 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.06 0 O5'-C5'-C4' 113.194 2.139 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.24 0 O5'-C5'-C4' 113.488 2.349 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O5'-C5'-C4' 113.529 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C1'-C2' 108.747 2.406 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.514 0 O5'-C5'-C4' 113.736 2.525 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.385 0 O4'-C4'-C3' 107.482 1.882 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.663 0 O4'-C4'-C3' 107.749 2.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.784 0 O5'-C5'-C4' 113.008 2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.942 0 O5'-C5'-C4' 113.316 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.708 0 O4'-C4'-C3' 107.573 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.592 ' O ' ' N ' ' A' ' 5' ' ' SER . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.449 ' C ' ' O ' ' A' ' 3' ' ' GLY . 55.6 t90 -39.45 91.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.43 -1.041 . . . . 0.0 109.79 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 3' ' ' GLY . 0.3 OUTLIER -110.69 140.59 44.92 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.523 -0.736 . . . . 0.0 109.448 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -55.49 -40.14 71.32 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.476 -0.765 . . . . 0.0 110.339 -178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -64.7 -42.36 95.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.919 -1.113 . . . . 0.0 109.587 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -57.77 -39.26 77.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.815 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.818 ' O ' HG12 ' A' ' 13' ' ' VAL . 2.9 mm-40 -71.23 -37.46 72.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.277 -0.889 . . . . 0.0 109.011 179.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -53.3 -49.57 66.72 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.88 . . . . 0.0 109.768 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -61.56 -37.61 84.47 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.162 -0.961 . . . . 0.0 109.275 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -65.77 -53.32 42.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.166 -0.959 . . . . 0.0 110.956 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.818 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.8 OUTLIER -72.76 -36.16 51.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.995 -1.066 . . . . 0.0 109.707 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -60.99 -40.99 95.57 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.261 -1.524 . . . . 0.0 108.421 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -59.05 -30.73 68.26 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.231 -0.918 . . . . 0.0 108.733 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.63 ' HA ' HD12 ' A' ' 19' ' ' ILE . 12.0 mt -67.31 -33.88 76.19 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.9 -0.72 . . . . 0.0 109.922 178.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -83.96 -40.9 17.91 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.636 -1.29 . . . . 0.0 110.723 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 19' ' ' ILE . 76.8 mm-40 -57.42 -32.23 66.67 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.054 -1.029 . . . . 0.0 109.322 -177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 16' ' ' LEU . 5.2 mt -44.62 -43.05 2.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 O-C-N 121.423 -0.798 . . . . 0.0 109.721 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 3.9 m120 -178.04 123.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.123 -0.986 . . . . 0.0 109.781 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.495 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 51.6 p30 -86.1 68.78 10.4 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.554 -0.716 . . . . 0.0 110.789 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.4 130.94 39.84 Favored Pre-proline 0 C--N 1.303 -1.414 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -40.08 -64.16 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.415 0 C-N-CA 122.118 1.879 . . . . 0.0 112.984 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -63.89 -39.26 93.78 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.705 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.547 ' NH2' HG21 ' A' ' 19' ' ' ILE . 58.7 ttt180 -59.78 -45.99 90.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.845 -1.16 . . . . 0.0 110.38 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -61.0 -47.46 86.34 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.829 -1.17 . . . . 0.0 108.697 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.514 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 84.9 tt0 -53.03 -27.68 20.8 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.389 0.614 . . . . 0.0 109.784 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -71.89 -61.68 1.7 Allowed 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.114 -0.991 . . . . 0.0 111.33 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.534 HD13 ' HB3' ' A' ' 16' ' ' LEU . 13.6 mt -60.27 -44.68 95.11 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.383 -0.823 . . . . 0.0 111.057 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.589 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 40.9 p-10 -64.37 -46.02 85.17 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 118.931 -1.107 . . . . 0.0 109.579 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.589 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 52.5 t0 -65.74 -43.54 88.65 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.289 -0.882 . . . . 0.0 109.445 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 tp -54.63 -49.09 71.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.188 -0.945 . . . . 0.0 109.578 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.522 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 51.5 m-85 -62.1 -34.62 76.67 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.75 -1.18 . . . . 0.0 107.856 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -69.3 -55.41 10.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.536 -0.728 . . . . 0.0 110.44 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 39.2 t80 -60.52 -38.3 83.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.282 -0.886 . . . . 0.0 110.929 -179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.4 mmm -60.15 -36.21 77.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.007 . . . . 0.0 110.946 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -57.91 -41.2 82.15 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.052 . . . . 0.0 110.335 -178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -65.01 -37.78 88.78 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.644 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -64.48 -30.11 71.15 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.837 -178.637 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.36 1.21 64.59 Favored Glycine 0 N--CA 1.482 1.742 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 -178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 41.9 p -114.43 84.3 9.5 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -85.11 143.16 9.01 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.514 2.143 . . . . 0.0 110.767 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 46' ' ' LEU . 53.5 mt -80.68 99.28 4.13 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 120.944 -1.098 . . . . 0.0 110.008 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 80.9 m-20 -64.48 -46.83 81.35 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -138.22 133.2 32.9 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 43' ' ' ILE . 9.5 mt -70.69 147.47 94.5 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 120.84 -1.163 . . . . 0.0 109.182 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.33 106.64 1.8 Allowed 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 121.556 1.504 . . . . 0.0 109.875 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.61 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 40.6 mt -77.15 142.55 14.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.131 -0.98 . . . . 0.0 109.947 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.746 ' SD ' HG21 ' A' ' 97' ' ' THR . 69.0 mmm -134.08 127.08 31.45 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 59.87 42.6 16.17 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 59.65 25.61 14.57 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.205 0.526 . . . . 0.0 110.409 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.524 ' N ' HG23 ' A' ' 48' ' ' ILE . 95.3 p -138.02 153.53 49.37 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.129 -0.982 . . . . 0.0 109.758 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.2 m -66.88 145.07 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.027 -1.046 . . . . 0.0 109.178 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 HD22 ' A' ' 59' ' ' LEU . 46.1 tp -79.7 125.31 29.48 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.366 -0.834 . . . . 0.0 109.999 -179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.555 ' OD1' HD13 ' A' ' 19' ' ' ILE . 84.1 m-20 -68.35 89.6 0.34 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.404 -0.81 . . . . 0.0 109.301 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt -52.03 -22.68 4.27 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.313 -0.867 . . . . 0.0 109.595 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.545 ' CE2' ' ND2' ' A' ' 61' ' ' ASN . 48.7 t80 -77.72 -55.38 5.39 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.06 -1.025 . . . . 0.0 111.66 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -61.81 -39.94 93.5 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.765 -1.209 . . . . 0.0 110.44 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.49 HD13 HD22 ' A' ' 98' ' ' LEU . 52.6 tp -59.55 -43.45 93.52 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 120.732 -1.23 . . . . 0.0 108.263 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.435 ' CE2' HG13 ' A' ' 64' ' ' ILE . 50.2 t80 -59.29 -66.75 0.46 Allowed 'General case' 0 C--N 1.296 -1.756 0 CA-C-O 121.484 0.659 . . . . 0.0 109.653 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' CE2' ' A' ' 57' ' ' TYR . 71.8 m-20 -42.54 -39.48 2.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.61 -0.681 . . . . 0.0 110.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.47 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.6 mt -72.5 -44.74 61.84 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.448 -1.301 . . . . 0.0 107.851 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.817 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.8 t -58.8 -45.49 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.135 -0.978 . . . . 0.0 110.16 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.435 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.7 mm -67.72 -35.5 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 120.681 -1.262 . . . . 0.0 108.412 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.481 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -54.85 -25.15 26.79 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 120.261 -0.575 . . . . 0.0 110.073 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.586 HH21 ' CB ' ' A' ' 80' ' ' GLU . 10.8 mpt_? -91.17 -2.79 57.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.574 -1.329 . . . . 0.0 108.953 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.74 18.72 61.1 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.14 178.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.417 ' N ' HD13 ' A' ' 116' ' ' LEU . . . 137.68 133.6 3.15 Favored Glycine 0 N--CA 1.501 3.031 0 CA-C-N 119.297 1.548 . . . . 0.0 111.41 178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' HH2' ' A' ' 78' ' ' TRP . 11.9 tp -51.13 -39.01 55.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.727 -0.866 . . . . 0.0 110.305 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.94 -43.3 74.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.037 -1.04 . . . . 0.0 109.543 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -58.05 -39.57 78.8 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.991 -1.068 . . . . 0.0 110.171 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' A' ' 76' ' ' LYS . 52.2 t -64.13 -43.58 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.38 -0.825 . . . . 0.0 110.291 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.403 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 80.8 mt -66.03 -57.92 8.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 O-C-N 120.655 -1.278 . . . . 0.0 110.249 -179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -58.26 -41.34 84.05 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.174 -0.954 . . . . 0.0 110.415 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -92.61 -9.09 42.29 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.144 -0.973 . . . . 0.0 110.653 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.0 mttp 57.67 57.3 4.34 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 -178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.539 HD13 ' CG ' ' A' ' 66' ' ' ARG . 14.7 mt -90.71 15.48 11.0 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 120.951 -1.093 . . . . 0.0 108.244 178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.611 ' HH2' HD11 ' A' ' 69' ' ' LEU . 91.4 m95 -65.69 -40.27 92.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.5 -0.75 . . . . 0.0 109.121 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.607 ' CD ' ' H ' ' A' ' 79' ' ' GLN . 5.4 mp0 -49.11 -38.71 25.63 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 118.389 -1.324 . . . . 0.0 108.16 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.586 ' CB ' HH21 ' A' ' 66' ' ' ARG . 96.7 mt-10 -69.76 -41.27 75.39 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mt -68.21 -52.69 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.641 HD11 ' HB2' ' A' ' 95' ' ' ALA . 72.0 mt -50.95 -56.57 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.557 -0.714 . . . . 0.0 109.139 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -70.22 -37.23 74.99 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.169 -0.957 . . . . 0.0 110.087 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.95 -32.73 34.94 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.0 mt -92.21 -7.07 49.32 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.365 -1.08 . . . . 0.0 109.135 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 68.09 40.97 2.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.746 -0.596 . . . . 0.0 110.122 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.27 140.45 85.21 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.102 -0.999 . . . . 0.0 108.844 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.557 ' C ' ' H ' ' A' ' 90' ' ' SER . 44.3 Cg_endo -70.69 141.57 41.76 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 C-N-CA 122.181 1.92 . . . . 0.0 112.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.8 p -55.83 -0.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.399 -0.813 . . . . 0.0 109.845 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.557 ' H ' ' C ' ' A' ' 88' ' ' PRO . 84.4 p -66.51 -26.82 67.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.168 -0.958 . . . . 0.0 109.947 -178.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.422 HD11 ' H ' ' A' ' 50' ' ' ALA . 80.3 mt -98.68 102.93 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.86 -1.15 . . . . 0.0 109.353 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.3 p -74.73 -27.79 60.51 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.167 -0.958 . . . . 0.0 109.044 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.5 m -94.2 37.82 1.1 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.475 -0.766 . . . . 0.0 109.196 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.69 -65.09 0.74 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.32 -0.862 . . . . 0.0 108.903 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.641 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.62 -51.7 20.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -0.894 . . . . 0.0 109.619 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.532 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 5.8 tp -58.73 -43.89 90.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.934 -1.104 . . . . 0.0 109.173 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.746 HG21 ' SD ' ' A' ' 49' ' ' MET . 10.6 m -62.69 -41.22 99.0 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.036 -1.04 . . . . 0.0 108.827 179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.49 HD22 HD13 ' A' ' 59' ' ' LEU . 9.7 mt -67.61 -43.08 81.31 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.428 -0.795 . . . . 0.0 109.509 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.707 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 39.7 ttm180 -68.62 -51.45 42.13 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.338 -0.851 . . . . 0.0 111.291 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.2 m -55.17 -52.32 63.69 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.195 -0.941 . . . . 0.0 110.009 -178.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -62.87 -42.09 99.63 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.201 -0.937 . . . . 0.0 111.377 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.6 t80 -58.55 -42.23 87.41 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.453 -1.404 . . . . 0.0 110.074 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.569 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.2 ttm -53.36 -54.79 31.46 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.377 -0.827 . . . . 0.0 111.253 -178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -73.45 -54.71 7.61 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.936 -1.102 . . . . 0.0 113.068 -176.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.413 ' C ' HD12 ' A' ' 106' ' ' LEU . 51.9 m-85 -84.07 -46.39 12.03 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 -174.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.679 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.1 mp -96.02 -5.9 40.02 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.189 -1.569 . . . . 0.0 113.631 -176.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.641 ' CZ ' ' SG ' ' A' ' 111' ' ' CYS . 83.2 t80 -59.89 -37.01 44.65 Favored Pre-proline 0 N--CA 1.493 1.725 0 O-C-N 119.966 -1.708 . . . . 0.0 110.123 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.637 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 13.4 Cg_exo -69.03 -52.86 0.35 Allowed 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.378 2.052 . . . . 0.0 112.501 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -59.91 -42.52 94.09 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.408 -0.807 . . . . 0.0 109.587 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -69.42 -51.53 35.52 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.35 -0.844 . . . . 0.0 110.324 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' ' CZ ' ' A' ' 107' ' ' TYR . 71.4 m -70.8 -42.36 70.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.348 -0.845 . . . . 0.0 110.49 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.6 tp10 -66.81 -51.48 55.21 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.837 -1.164 . . . . 0.0 111.149 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -74.28 -26.12 60.01 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.035 -1.04 . . . . 0.0 111.408 -178.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.485 ' HG2' HD21 ' A' ' 116' ' ' LEU . 38.5 tptt -125.76 -29.73 3.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.977 -1.077 . . . . 0.0 111.607 -177.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.554 ' N ' ' O ' ' A' ' 111' ' ' CYS . 37.4 t30 55.96 45.82 23.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.685 -1.259 . . . . 0.0 109.885 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.485 HD21 ' HG2' ' A' ' 114' ' ' LYS . 53.3 mt -66.77 -33.14 74.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.267 -0.895 . . . . 0.0 111.174 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.496 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 10.7 t -155.57 -161.09 1.11 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 118.893 -1.123 . . . . 0.0 111.341 -178.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 71.1 p -125.53 164.22 33.85 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.738 -0.601 . . . . 0.0 109.66 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.495 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 16.5 Cg_exo -64.54 -36.14 44.63 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.549 1.499 . . . . 0.0 111.873 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.29 82.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.098 -1.001 . . . . 0.0 109.356 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.496 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 48.3 mt-10 -67.33 -45.22 77.06 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.569 HD21 ' HG3' ' A' ' 103' ' ' MET . 14.7 tp -66.2 -50.87 62.38 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.486 -0.759 . . . . 0.0 109.501 178.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -59.05 -46.17 88.9 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.098 -1.001 . . . . 0.0 109.311 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.73 97.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.373 -0.829 . . . . 0.0 110.381 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.69 73.63 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.508 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.1 mt -66.63 -51.16 59.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.976 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.08 -39.52 94.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.467 -0.77 . . . . 0.0 109.791 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -30.56 72.16 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.707 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 28.6 p30 -89.57 -24.99 21.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.335 -1.097 . . . . 0.0 110.299 -178.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.645 HH11 ' HB3' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -62.83 141.13 58.77 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.998 -1.064 . . . . 0.0 109.595 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.518 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.4 mpt_? -66.35 150.26 49.14 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.428 -0.795 . . . . 0.0 110.014 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.94 -20.68 58.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.43 -0.794 . . . . 0.0 109.336 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.998 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.875 ' H6 ' " O5'" ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C1'-C2' 108.833 2.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.088 0 O4'-C4'-C3' 107.962 2.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.981 0 O4'-C4'-C3' 107.452 1.852 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.212 0 O5'-C5'-C4' 113.288 2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.955 0 O5'-C5'-C4' 113.087 2.062 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.022 0 O4'-C4'-C3' 107.668 2.068 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.675 0 O4'-C4'-C3' 107.656 2.056 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.61 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.194 0 O4'-C1'-C2' 108.426 2.115 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.254 0 O5'-C5'-C4' 113.251 2.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.127 0 O4'-C4'-C3' 107.826 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.849 0 O5'-C5'-C4' 112.995 1.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.157 0 O4'-C4'-C3' 107.835 2.235 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.018 0 O4'-C4'-C3' 107.692 2.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.976 0 O4'-C4'-C3' 107.413 1.813 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.023 0 O4'-C4'-C3' 107.901 2.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.463 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.422 -2.209 0 C4'-C3'-C2' 104.618 1.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.133 0 O4'-C1'-C2' 108.726 2.387 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.511 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.006 0 O5'-C5'-C4' 112.56 1.685 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.511 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.792 0 O5'-C5'-C4' 113.788 2.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.795 0 O4'-C4'-C3' 107.686 2.086 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.532 ' H73' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.805 0 O4'-C4'-C3' 107.772 2.172 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.67 0 O5'-C5'-C4' 113.336 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.781 0 O5'-C5'-C4' 113.613 2.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.055 0 O4'-C1'-C2' 108.83 2.481 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.097 0 O4'-C4'-C3' 107.93 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C4'-C3' 107.693 2.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.238 0 O4'-C4'-C3' 107.923 2.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.427 -1.738 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.844 0 O4'-C4'-C3' 107.8 2.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.753 0 O4'-C4'-C3' 107.381 1.781 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.602 ' CH2' ' ND2' ' A' ' 44' ' ' ASN . 33.6 p90 -76.24 142.25 41.48 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.234 -1.157 . . . . 0.0 109.566 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.14 135.41 39.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 109.613 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -54.62 -36.72 64.8 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.398 -0.814 . . . . 0.0 110.036 -178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -64.51 -41.71 96.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.949 -1.094 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -54.4 -43.85 71.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.908 . . . . 0.0 109.719 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.887 ' O ' HG12 ' A' ' 13' ' ' VAL . 47.8 mt-30 -69.59 -37.11 76.78 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.0 -1.063 . . . . 0.0 109.81 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -48.56 -49.28 37.19 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 109.791 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -61.76 -40.04 93.75 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.418 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -67.42 -53.24 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.368 -0.833 . . . . 0.0 111.549 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.887 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.1 p -69.69 -38.72 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.038 -1.039 . . . . 0.0 110.197 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -60.72 -39.28 88.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.125 -1.61 . . . . 0.0 108.258 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.405 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.1 OUTLIER -58.31 -29.44 65.89 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.229 -0.92 . . . . 0.0 108.68 178.689 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.486 HD11 HD22 ' A' ' 46' ' ' LEU . 9.6 mt -69.75 -40.22 76.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.44 -0.787 . . . . 0.0 111.464 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.454 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 91.4 m-85 -75.22 -36.83 61.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.402 -1.436 . . . . 0.0 109.864 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.481 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -62.32 -28.13 69.52 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 110.81 -177.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.634 HD13 ' NH2' ' A' ' 25' ' ' ARG . 23.3 mt -37.43 -41.42 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 O-C-N 121.602 -0.686 . . . . 0.0 110.738 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.612 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.82 168.18 5.08 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.733 -1.229 . . . . 0.0 110.598 179.684 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 89.9 m-20 -90.97 65.5 5.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.614 -0.678 . . . . 0.0 110.526 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.65 137.3 20.21 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.201 -0.937 . . . . 0.0 108.563 179.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -74.88 -61.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.493 1.442 0 C-N-CA 122.078 1.852 . . . . 0.0 112.262 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -34.89 71.17 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.132 -0.98 . . . . 0.0 109.581 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.634 ' NH2' HD13 ' A' ' 19' ' ' ILE . 59.6 ttt180 -58.48 -42.22 87.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.179 -0.95 . . . . 0.0 110.166 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -60.29 -53.29 59.36 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.86 -1.136 . . . . 0.0 108.482 -179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -53.22 -35.55 60.05 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.567 -0.708 . . . . 0.0 109.244 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -64.45 -61.84 1.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.448 -0.783 . . . . 0.0 110.995 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.482 HD13 ' HB3' ' A' ' 16' ' ' LEU . 70.7 mt -55.07 -46.96 75.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.915 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 39.1 m-20 -62.65 -46.64 87.29 Favored 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.492 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -67.17 -43.59 81.86 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.018 -1.051 . . . . 0.0 109.448 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 52.9 tp -56.32 -50.59 71.02 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.223 -0.923 . . . . 0.0 109.981 -179.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -61.78 -34.13 75.32 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.108 -1.437 . . . . 0.0 107.709 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.4 m -69.51 -53.02 21.12 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.438 -0.789 . . . . 0.0 109.553 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.419 ' CZ ' ' HD2' ' A' ' 39' ' ' ARG . 60.0 t80 -59.14 -44.0 92.05 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.499 -0.751 . . . . 0.0 110.304 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 73.4 mmm -59.03 -37.46 77.03 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.666 -0.646 . . . . 0.0 110.462 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -59.39 -41.53 89.59 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.095 -1.003 . . . . 0.0 109.97 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.7 ttmm -65.62 -46.34 79.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.511 HH11 ' HB2' ' A' ' 108' ' ' PRO . 2.8 mtp180 -62.59 -23.68 67.16 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.336 -0.852 . . . . 0.0 110.719 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 96.41 2.08 60.45 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 68.2 p -117.24 83.36 15.72 Favored Pre-proline 0 N--CA 1.493 1.693 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -86.98 145.62 7.58 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.987 2.458 . . . . 0.0 111.7 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD23 ' A' ' 46' ' ' LEU . 47.6 mt -79.86 98.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.082 -1.011 . . . . 0.0 109.142 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.602 ' ND2' ' CH2' ' A' ' 4' ' ' TRP . 19.8 m120 -63.14 -45.14 93.35 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -138.51 134.91 34.53 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.596 HD23 HG21 ' A' ' 43' ' ' ILE . 12.0 mt -70.93 144.62 90.64 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.816 -1.178 . . . . 0.0 109.463 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -72.78 116.29 4.66 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 121.587 1.524 . . . . 0.0 109.425 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.608 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 52.7 mt -82.59 144.19 10.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.001 -1.062 . . . . 0.0 110.061 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.679 ' SD ' HG21 ' A' ' 97' ' ' THR . 46.9 mmm -139.59 124.97 19.06 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 66.7 41.06 3.09 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -177.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.3 mttm 59.16 22.69 10.89 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.342 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.494 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -140.02 157.43 45.68 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.987 -1.071 . . . . 0.0 110.133 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.7 m -66.73 144.3 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 120.964 -1.085 . . . . 0.0 109.019 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.559 HD21 HD22 ' A' ' 59' ' ' LEU . 44.0 tp -78.63 124.07 27.79 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.364 -0.835 . . . . 0.0 109.767 -179.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.515 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.0 m-20 -65.74 90.68 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.441 -0.787 . . . . 0.0 109.246 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 mt -55.44 -23.85 27.53 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.075 -1.016 . . . . 0.0 109.186 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -80.31 -57.94 3.37 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.179 -0.951 . . . . 0.0 111.58 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.7 -38.78 79.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.55 -1.344 . . . . 0.0 108.88 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.559 HD22 HD21 ' A' ' 54' ' ' LEU . 53.7 tp -58.18 -46.2 86.16 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.429 ' CE2' HG13 ' A' ' 64' ' ' ILE . 53.5 t80 -59.45 -66.18 0.55 Allowed 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.453 0.644 . . . . 0.0 109.303 178.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -42.04 -40.77 2.35 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.508 -0.745 . . . . 0.0 110.571 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.1 mt -71.69 -45.73 60.97 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.011 -1.476 . . . . 0.0 107.797 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.809 HG21 ' CE2' ' A' ' 102' ' ' TYR . 41.3 t -56.18 -45.07 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.137 -0.977 . . . . 0.0 110.253 179.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.429 HG13 ' CE2' ' A' ' 60' ' ' TYR . 9.7 mm -67.99 -35.98 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.665 -1.272 . . . . 0.0 107.894 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.31 -20.79 45.93 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.488 -178.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.637 HH21 ' CB ' ' A' ' 80' ' ' GLU . 21.2 mmt-85 -93.88 0.81 56.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.579 -1.326 . . . . 0.0 108.443 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.39 13.62 73.12 Favored Glycine 0 N--CA 1.492 2.395 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.981 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 137.42 135.92 3.42 Favored Glycine 0 N--CA 1.502 3.058 0 CA-C-N 119.366 1.583 . . . . 0.0 111.391 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.611 HD11 ' CH2' ' A' ' 78' ' ' TRP . 11.0 tp -52.42 -39.62 61.21 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.553 -0.969 . . . . 0.0 110.374 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.506 HG22 ' HA ' ' A' ' 122' ' ' LEU . 85.3 t -58.74 -45.1 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.02 -1.05 . . . . 0.0 109.772 -178.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -55.33 -39.16 69.65 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.029 -1.045 . . . . 0.0 108.651 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.8 t -63.94 -41.23 91.84 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.506 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.403 HG12 ' NH1' ' A' ' 99' ' ' ARG . 64.0 mt -66.96 -61.86 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 O-C-N 120.82 -1.175 . . . . 0.0 110.384 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -57.73 -40.16 78.99 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.192 -0.942 . . . . 0.0 110.215 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -91.61 -11.63 36.6 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.172 -0.955 . . . . 0.0 110.685 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 26.1 mtmt 58.73 60.11 2.64 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -178.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.8 mt -94.63 14.44 21.03 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.935 -1.103 . . . . 0.0 108.773 178.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.611 ' CH2' HD11 ' A' ' 69' ' ' LEU . 81.6 m95 -62.97 -39.52 94.95 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.124 -0.985 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 78' ' ' TRP . 95.4 mm-40 -48.85 -39.39 25.46 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.379 -1.451 . . . . 0.0 108.371 178.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.637 ' CB ' HH21 ' A' ' 66' ' ' ARG . 79.0 mm-40 -66.25 -39.93 89.84 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.406 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -73.67 -50.55 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.553 -0.717 . . . . 0.0 109.211 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.781 HD11 ' HB2' ' A' ' 95' ' ' ALA . 79.7 mt -51.8 -54.02 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.509 -0.744 . . . . 0.0 109.5 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.41 -38.9 68.28 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.037 -1.04 . . . . 0.0 110.191 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.74 -32.37 40.04 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 86.3 mt -90.47 -7.05 54.03 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.393 -1.063 . . . . 0.0 109.156 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 65.85 40.44 4.22 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.838 -0.539 . . . . 0.0 110.633 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.9 mt -72.73 141.5 82.37 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.191 -0.943 . . . . 0.0 108.483 178.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.553 ' C ' ' H ' ' A' ' 90' ' ' SER . 57.6 Cg_endo -73.32 143.66 35.53 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.055 1.837 . . . . 0.0 112.532 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.7 m -58.06 1.42 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.356 -0.84 . . . . 0.0 109.664 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.553 ' H ' ' C ' ' A' ' 88' ' ' PRO . 94.6 p -66.57 -24.56 66.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.186 -0.947 . . . . 0.0 109.966 -178.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.544 HD11 ' H ' ' A' ' 50' ' ' ALA . 81.6 mt -103.06 107.09 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 120.989 -1.069 . . . . 0.0 109.412 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.3 p -76.48 -28.15 56.36 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 108.729 179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.9 m -90.26 30.95 1.04 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.531 -0.731 . . . . 0.0 109.36 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.24 -64.74 0.85 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.781 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.57 -52.73 36.35 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.314 -0.866 . . . . 0.0 109.409 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.8 tp -58.96 -44.71 91.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.825 -1.172 . . . . 0.0 108.884 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.679 HG21 ' SD ' ' A' ' 49' ' ' MET . 55.1 m -59.06 -40.87 86.46 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 59' ' ' LEU . 13.9 mt -68.75 -42.23 77.83 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.616 -0.678 . . . . 0.0 109.266 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.465 ' HG3' HH11 ' A' ' 99' ' ' ARG . 11.1 ttm-85 -65.05 -52.37 56.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.123 -0.986 . . . . 0.0 110.415 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.5 m -57.32 -53.65 55.67 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.429 -0.794 . . . . 0.0 110.341 -178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -64.79 -44.53 89.67 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.831 -1.168 . . . . 0.0 112.178 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 63' ' ' VAL . 4.7 t80 -57.91 -40.12 79.62 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.087 -1.633 . . . . 0.0 108.783 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 1.013 ' SD ' HD21 ' A' ' 122' ' ' LEU . 55.8 mmm -52.55 -58.86 5.43 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.67 -0.644 . . . . 0.0 111.909 -179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -73.76 -50.8 18.89 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.559 -1.338 . . . . 0.0 112.818 -176.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.468 ' C ' HD12 ' A' ' 106' ' ' LEU . 63.8 m-85 -83.97 -48.53 9.86 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -175.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.9 mp -99.39 6.04 46.18 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.255 -1.528 . . . . 0.0 113.819 -176.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.528 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 36.0 t80 -66.58 -38.84 21.27 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.042 -1.661 . . . . 0.0 111.09 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.2 Cg_endo -78.64 -41.55 0.25 Allowed 'Trans proline' 0 N--CA 1.487 1.145 0 C-N-CA 121.472 1.448 . . . . 0.0 112.568 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.78 -42.62 89.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.85 -1.156 . . . . 0.0 108.348 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.96 -43.56 62.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.436 -0.79 . . . . 0.0 110.035 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.586 ' O ' ' N ' ' A' ' 115' ' ' ASN . 1.8 t -79.95 -46.27 17.01 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.1 -1.0 . . . . 0.0 110.927 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 108' ' ' PRO . 49.8 tp10 -66.34 -45.62 79.6 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 120.737 -1.227 . . . . 0.0 110.634 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -75.34 -35.37 61.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.115 -0.99 . . . . 0.0 110.965 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.491 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.1 tptp -118.39 -27.15 6.06 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.012 -1.055 . . . . 0.0 111.876 -177.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 111' ' ' CYS . 36.6 t-20 55.08 45.48 26.11 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.748 -1.22 . . . . 0.0 110.474 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' A' ' 114' ' ' LYS . 68.2 mt -66.2 -28.16 68.54 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.105 -0.997 . . . . 0.0 110.561 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.477 ' OG ' ' N ' ' A' ' 118' ' ' THR . 37.8 t -153.02 -167.03 2.61 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.153 -1.019 . . . . 0.0 111.056 -178.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.477 ' N ' ' OG ' ' A' ' 117' ' ' SER . 65.5 p -127.32 159.12 67.02 Favored Pre-proline 0 N--CA 1.498 1.971 0 O-C-N 121.574 -0.704 . . . . 0.0 110.171 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -55.97 -41.94 71.89 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.691 1.594 . . . . 0.0 112.665 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.2 -38.6 91.81 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.878 -1.139 . . . . 0.0 109.754 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.55 -44.37 82.51 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.013 HD21 ' SD ' ' A' ' 103' ' ' MET . 15.2 tp -66.55 -52.41 45.93 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.664 -0.648 . . . . 0.0 110.251 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -57.64 -46.18 84.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.055 -1.028 . . . . 0.0 109.554 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.78 87.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.35 -0.844 . . . . 0.0 110.068 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.85 -34.55 76.92 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.285 -0.885 . . . . 0.0 108.75 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.599 ' CD1' ' HE1' ' A' ' 103' ' ' MET . 10.4 mt -66.25 -49.09 78.59 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.933 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -61.68 -38.24 87.07 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.069 -1.019 . . . . 0.0 108.709 179.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.59 -28.71 73.57 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 23.9 p-10 -89.92 -30.19 18.02 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.694 -1.474 . . . . 0.0 110.335 -178.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.655 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 0.0 OUTLIER -63.38 142.95 58.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.886 -1.134 . . . . 0.0 109.123 179.345 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.543 ' NH1' ' O ' ' A' ' 129' ' ' ASN . 10.4 mpt_? -69.29 144.72 53.5 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.519 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -74.43 1.02 12.75 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.408 -0.807 . . . . 0.0 109.506 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.931 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.873 ' H6 ' " O5'" ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.125 0 O4'-C1'-C2' 108.841 2.492 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.033 0 O4'-C4'-C3' 107.929 2.329 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.887 0 O4'-C4'-C3' 107.517 1.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.353 0 O4'-C4'-C3' 107.91 2.31 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O5'-C5'-C4' 113.088 2.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.08 0 O5'-C5'-C4' 113.175 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.728 0 O4'-C4'-C3' 107.393 1.793 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.608 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.154 0 O4'-C4'-C3' 107.729 2.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.006 0 O5'-C5'-C4' 113.122 2.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.45 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.09 0 O4'-C4'-C3' 107.874 2.274 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.45 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.722 0 O5'-C5'-C4' 112.955 1.968 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.82 0 O5'-C5'-C4' 113.2 2.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C4'-C3' 107.725 2.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 0 O4'-C4'-C3' 107.371 1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.05 0 O4'-C4'-C3' 107.975 2.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.467 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.264 0 O4'-C1'-N19 106.657 -1.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.467 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O4'-C4'-C3' 108.123 2.523 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.405 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.528 2.095 0 O5'-C5'-C4' 112.506 1.647 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.804 0 O5'-C5'-C4' 113.717 2.512 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.969 0 O4'-C4'-C3' 107.66 2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.571 ' P ' HH12 ' A' ' 130' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.822 0 O5'-C5'-C4' 113.141 2.1 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.034 0 O5'-C5'-C4' 113.228 2.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.104 0 O5'-C5'-C4' 113.45 2.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.184 0 O4'-C1'-C2' 108.663 2.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.322 0 O4'-C4'-C3' 108.051 2.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.21 0 O4'-C4'-C3' 107.826 2.226 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.306 0 O4'-C4'-C3' 107.802 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.891 0 O4'-C4'-C3' 107.853 2.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.021 0 O4'-C4'-C3' 107.74 2.14 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.944 0 O4'-C4'-C3' 107.515 1.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 35.2 p90 -67.78 152.23 45.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.192 -1.181 . . . . 0.0 109.559 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.65 137.22 37.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.332 -0.855 . . . . 0.0 109.568 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -55.77 -37.18 68.21 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.441 -0.787 . . . . 0.0 109.871 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.27 -43.17 98.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.788 -1.195 . . . . 0.0 108.761 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -55.85 -40.5 72.96 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.333 -0.854 . . . . 0.0 108.846 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 44' ' ' ASN . 33.3 mm-40 -77.39 -37.99 50.8 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.338 -0.851 . . . . 0.0 109.59 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.01 -49.76 65.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.975 -1.078 . . . . 0.0 109.649 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -62.19 -42.14 99.0 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.172 -0.955 . . . . 0.0 109.336 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.41 ' C ' HD11 ' A' ' 46' ' ' LEU . 18.0 mm100 -65.27 -49.76 68.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.58 -0.7 . . . . 0.0 110.805 -179.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.41 HG13 ' O ' ' A' ' 9' ' ' GLN . 4.1 m -71.74 -35.99 57.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 120.692 -1.255 . . . . 0.0 108.641 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.494 ' O ' ' OE1' ' A' ' 18' ' ' GLU . 6.9 tpt180 -54.56 -40.81 69.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.614 -1.304 . . . . 0.0 107.532 178.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -58.49 -31.4 67.81 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.452 ' HA ' HD12 ' A' ' 19' ' ' ILE . 10.2 mt -72.63 -37.34 68.06 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.433 -0.792 . . . . 0.0 111.469 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 29' ' ' LEU . 97.5 m-85 -77.49 -33.13 54.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.364 -1.46 . . . . 0.0 110.009 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.503 ' O ' ' C ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -69.48 -27.86 65.58 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.088 -1.007 . . . . 0.0 111.282 -177.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.503 ' C ' ' O ' ' A' ' 18' ' ' GLU . 19.3 mt -35.74 -38.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.672 -0.642 . . . . 0.0 110.161 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.515 ' ND2' ' N ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -173.56 168.24 4.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.071 -1.018 . . . . 0.0 110.153 179.666 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -90.86 74.43 6.5 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.656 -0.653 . . . . 0.0 110.044 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -108.82 134.36 20.36 Favored Pre-proline 0 N--CA 1.491 1.613 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.7 -59.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.491 1.34 0 C-N-CA 122.079 1.853 . . . . 0.0 112.305 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -58.66 -34.18 70.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.616 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.692 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -57.09 -42.12 80.16 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.016 -1.052 . . . . 0.0 109.384 -179.613 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -61.4 -54.27 45.75 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.903 -1.123 . . . . 0.0 108.707 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -52.97 -37.24 61.02 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -62.47 -62.57 1.66 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.48 -0.763 . . . . 0.0 109.854 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.514 HD21 HH12 ' A' ' 25' ' ' ARG . 82.0 mt -54.8 -46.34 74.47 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 121.528 0.68 . . . . 0.0 109.72 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -61.4 -49.65 76.01 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.003 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -66.54 -43.62 84.64 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.179 -0.95 . . . . 0.0 110.197 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.33 -52.12 64.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.152 -0.967 . . . . 0.0 110.416 -178.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.448 ' CE1' HD12 ' A' ' 43' ' ' ILE . 43.9 m-85 -62.48 -32.63 73.56 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.771 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 t -67.51 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 111.311 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.597 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -63.6 -27.32 69.16 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 111.232 -178.422 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.0 mmm -64.13 -39.55 94.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.934 -1.104 . . . . 0.0 111.057 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -62.09 -36.39 81.56 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.939 -1.101 . . . . 0.0 110.524 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -59.4 -50.09 75.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.211 -0.931 . . . . 0.0 111.065 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.436 HH11 ' HB3' ' A' ' 108' ' ' PRO . 28.5 mtp180 -64.19 -19.78 65.56 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.807 -178.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 99.91 3.47 55.91 Favored Glycine 0 N--CA 1.482 1.718 0 N-CA-C 108.187 -1.965 . . . . 0.0 108.187 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.1 p -117.42 83.99 17.58 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.587 -0.949 . . . . 0.0 108.943 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -93.66 150.36 2.3 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 123.441 2.76 . . . . 0.0 111.755 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.533 HG21 HD23 ' A' ' 46' ' ' LEU . 55.7 mt -84.87 98.19 5.96 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 120.865 -1.147 . . . . 0.0 109.153 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 25.0 m120 -79.65 -12.95 59.8 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.466 ' CG ' ' O ' ' A' ' 45' ' ' ARG . 0.5 OUTLIER -159.4 122.93 3.72 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.533 HD23 HG21 ' A' ' 43' ' ' ILE . 3.6 mt -71.46 147.1 92.41 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 120.728 -1.232 . . . . 0.0 109.349 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.82 138.14 40.15 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 121.279 1.319 . . . . 0.0 108.967 176.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.544 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.6 mt -105.64 146.08 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 120.9 -1.125 . . . . 0.0 110.17 -178.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.669 ' SD ' HD13 ' A' ' 54' ' ' LEU . 77.9 mtp -143.26 122.37 12.9 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 69.47 39.8 1.54 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 72.6 mttt 58.15 24.49 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.478 0.656 . . . . 0.0 109.654 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' HG23 ' A' ' 48' ' ' ILE . 85.8 p -138.31 157.3 46.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.533 -0.729 . . . . 0.0 109.153 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -69.54 149.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.965 -1.084 . . . . 0.0 109.472 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.68 HD21 HD22 ' A' ' 59' ' ' LEU . 59.1 tp -82.12 124.24 29.68 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.378 -0.826 . . . . 0.0 109.741 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.41 92.94 0.07 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.592 -0.693 . . . . 0.0 110.065 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -54.34 -26.21 28.57 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 120.821 -1.174 . . . . 0.0 109.318 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -78.4 -62.6 1.63 Allowed 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.951 . . . . 0.0 111.584 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.68 -36.65 67.35 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.685 -1.259 . . . . 0.0 109.458 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.68 HD22 HD21 ' A' ' 54' ' ' LEU . 54.6 tp -61.07 -45.63 93.97 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 178.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.456 ' CE2' HG13 ' A' ' 64' ' ' ILE . 67.8 t80 -61.83 -68.13 0.35 Allowed 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.296 0.569 . . . . 0.0 109.506 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.431 ' C ' ' O ' ' A' ' 60' ' ' TYR . 57.3 t30 -42.57 -36.98 1.52 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.405 -0.809 . . . . 0.0 109.567 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.625 HD13 ' HA ' ' A' ' 81' ' ' ILE . 8.0 mt -70.42 -50.86 34.14 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.031 -1.043 . . . . 0.0 108.448 178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.866 HG21 ' CE2' ' A' ' 102' ' ' TYR . 42.3 t -58.05 -42.59 83.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.655 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.097 -179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.456 HG13 ' CE2' ' A' ' 60' ' ' TYR . 11.2 mm -70.14 -34.82 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.572 -1.33 . . . . 0.0 108.151 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.445 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.33 -24.1 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.735 -0.603 . . . . 0.0 110.724 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.515 ' CG ' HD13 ' A' ' 77' ' ' LEU . 8.0 mpt_? -94.14 3.72 54.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.622 -1.298 . . . . 0.0 109.564 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 16.21 69.99 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.251 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.92 134.89 3.38 Favored Glycine 0 N--CA 1.501 2.995 0 O-C-N 120.502 -1.587 . . . . 0.0 111.424 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.636 HD11 ' CH2' ' A' ' 78' ' ' TRP . 16.1 tp -52.74 -40.18 62.83 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.644 -0.916 . . . . 0.0 110.863 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.565 HG11 ' HB3' ' A' ' 121' ' ' GLU . 58.6 t -57.05 -42.98 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.893 -1.129 . . . . 0.0 109.318 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -57.56 -40.39 78.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.918 -1.113 . . . . 0.0 109.538 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.628 ' O ' ' N ' ' A' ' 76' ' ' LYS . 78.8 t -64.69 -43.19 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.376 -0.828 . . . . 0.0 110.271 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.426 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 61.1 mt -66.33 -55.4 18.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 O-C-N 120.878 -1.139 . . . . 0.0 110.273 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 89.5 m-20 -57.63 -42.39 83.3 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.159 -0.963 . . . . 0.0 110.266 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -93.58 -9.4 38.27 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.196 -0.94 . . . . 0.0 110.643 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.628 ' N ' ' O ' ' A' ' 72' ' ' VAL . 27.2 mtmm 58.56 60.17 2.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.409 -0.807 . . . . 0.0 109.849 -178.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.515 HD13 ' CG ' ' A' ' 66' ' ' ARG . 17.1 mt -90.88 14.94 12.34 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.636 ' CH2' HD11 ' A' ' 69' ' ' LEU . 99.0 m95 -61.27 -40.86 95.68 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.515 HE21 " H4'" ' C' ' 418' ' ' ' DA' . 83.5 mt-30 -47.22 -39.9 15.1 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 120.748 -1.22 . . . . 0.0 108.673 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' ' NH2' ' A' ' 66' ' ' ARG . 76.5 mm-40 -68.54 -41.68 79.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.625 ' HA ' HD13 ' A' ' 62' ' ' LEU . 4.2 mt -69.5 -52.85 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.55 HD11 ' HB2' ' A' ' 95' ' ' ALA . 50.5 mt -53.98 -55.34 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.607 -0.683 . . . . 0.0 109.448 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.44 ' O ' ' N ' ' A' ' 86' ' ' HIS . 68.5 mttt -68.4 -42.27 79.27 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.336 -0.853 . . . . 0.0 109.869 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -51.16 -31.36 26.29 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.3 mt -91.15 -7.45 51.46 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.463 -1.022 . . . . 0.0 109.037 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 83' ' ' LYS . 71.3 m-70 62.8 42.32 8.06 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.837 -0.539 . . . . 0.0 110.124 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.7 mt -71.95 137.61 82.28 Favored Pre-proline 0 N--CA 1.488 1.453 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.586 ' C ' ' H ' ' A' ' 90' ' ' SER . 31.6 Cg_endo -66.9 141.57 59.23 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 121.892 1.728 . . . . 0.0 112.264 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 32.5 m -55.82 1.26 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.201 -0.937 . . . . 0.0 109.995 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.586 ' H ' ' C ' ' A' ' 88' ' ' PRO . 85.4 p -65.89 -25.35 67.13 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.099 -1.001 . . . . 0.0 109.805 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.549 HD11 ' H ' ' A' ' 50' ' ' ALA . 74.1 mt -100.47 103.64 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.064 -1.023 . . . . 0.0 109.205 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.4 p -76.98 -23.32 52.3 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.178 -0.951 . . . . 0.0 109.164 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.1 m -100.25 39.27 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.448 -0.783 . . . . 0.0 109.067 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.55 -63.75 1.05 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.307 -0.87 . . . . 0.0 109.294 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.55 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.23 -51.53 14.19 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.21 -0.932 . . . . 0.0 109.612 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.0 tp -59.01 -43.32 91.53 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.774 -1.204 . . . . 0.0 108.895 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 63.6 m -60.92 -41.24 95.77 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 120.992 -1.067 . . . . 0.0 108.531 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 95' ' ' ALA . 10.4 mt -70.19 -44.11 69.37 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.498 -0.751 . . . . 0.0 109.841 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.569 HH12 ' HE1' ' A' ' 78' ' ' TRP . 3.3 ttm-85 -67.0 -53.37 32.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.292 -0.88 . . . . 0.0 110.925 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.6 m -55.0 -50.06 69.95 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.029 -1.044 . . . . 0.0 109.335 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -64.2 -43.87 93.72 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.145 -0.972 . . . . 0.0 111.624 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.866 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.35 -41.42 84.64 Favored 'General case' 0 N--CA 1.486 1.375 0 O-C-N 120.422 -1.424 . . . . 0.0 109.183 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.761 ' HG2' HD21 ' A' ' 122' ' ' LEU . 81.5 mtp -50.91 -56.48 12.1 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.584 -0.697 . . . . 0.0 111.431 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.0 mttt -73.58 -55.92 5.69 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.933 -1.104 . . . . 0.0 113.15 -176.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' LEU . 56.2 m-85 -84.24 -46.4 11.87 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 115.4 1.629 . . . . 0.0 115.4 -174.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 106' ' ' LEU . 5.8 mp -97.6 -4.87 36.75 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.212 -1.555 . . . . 0.0 113.177 -176.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 39.2 t80 -62.81 -36.65 27.3 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 120.074 -1.641 . . . . 0.0 109.466 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 16.6 Cg_exo -66.17 -52.74 0.79 Allowed 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 122.15 1.9 . . . . 0.0 111.678 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -58.29 -48.46 80.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.292 -0.88 . . . . 0.0 109.504 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.49 -47.77 69.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.118 -0.989 . . . . 0.0 110.368 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 115' ' ' ASN . 3.6 t -73.99 -46.36 44.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.984 -1.073 . . . . 0.0 110.719 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.597 ' OE1' ' CZ ' ' A' ' 35' ' ' PHE . 35.2 tt0 -66.88 -51.89 50.0 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 120.904 -1.122 . . . . 0.0 111.304 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm -74.57 -32.39 62.38 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.119 -0.988 . . . . 0.0 111.874 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.41 ' HG2' HD21 ' A' ' 116' ' ' LEU . 35.4 tptt -117.25 -29.69 5.82 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.895 -1.128 . . . . 0.0 111.616 -177.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.426 ' N ' ' O ' ' A' ' 111' ' ' CYS . 19.0 t-20 54.83 44.78 27.88 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.683 -1.261 . . . . 0.0 110.481 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD21 ' HG2' ' A' ' 114' ' ' LYS . 74.7 mt -67.36 -28.33 67.86 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.992 -1.068 . . . . 0.0 110.903 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 118' ' ' THR . 4.5 t -153.61 -168.17 2.91 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.273 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.597 ' N ' ' OG ' ' A' ' 117' ' ' SER . 71.1 p -122.8 152.5 62.51 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.676 -0.64 . . . . 0.0 109.53 -178.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.415 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 9.5 Cg_endo -55.02 -36.76 93.45 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 C-N-CA 122.042 1.828 . . . . 0.0 112.08 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.33 83.24 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.943 -1.098 . . . . 0.0 109.243 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.565 ' HB3' HG11 ' A' ' 70' ' ' VAL . 98.7 mt-10 -65.93 -44.49 84.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 177.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.761 HD21 ' HG2' ' A' ' 103' ' ' MET . 33.0 tp -63.56 -51.79 63.85 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.727 -0.608 . . . . 0.0 109.445 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -58.01 -50.13 74.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.241 -0.912 . . . . 0.0 109.658 178.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.24 -41.4 96.83 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.41 -0.806 . . . . 0.0 110.209 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.469 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.22 -33.57 74.66 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.64 HD11 ' SD ' ' A' ' 103' ' ' MET . 5.5 mt -63.46 -49.78 81.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.97 -36.96 82.99 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.23 -32.98 78.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.683 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.2 OUTLIER -92.59 -29.47 16.13 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.016 -1.285 . . . . 0.0 110.366 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.714 HH22 ' P ' ' C' ' 421' ' ' ' DT' . 0.0 OUTLIER -61.13 141.65 57.29 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.088 -1.007 . . . . 0.0 109.855 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.463 ' NH1' ' O ' ' A' ' 129' ' ' ASN . 11.6 mpt_? -74.43 156.62 36.8 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.429 -0.794 . . . . 0.0 109.353 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -94.03 111.33 23.03 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.257 -0.902 . . . . 0.0 109.191 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.917 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.848 ' H6 ' " O5'" ' B' ' 401' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.926 0 O4'-C1'-C2' 108.752 2.411 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.1 0 O4'-C4'-C3' 107.942 2.342 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O5'-C5'-C4' 112.689 1.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.427 0 O5'-C5'-C4' 113.505 2.361 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.133 0 O5'-C5'-C4' 113.181 2.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.177 0 O5'-C5'-C4' 112.995 1.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.057 0 O5'-C5'-C4' 113.038 2.027 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.544 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.267 0 O4'-C1'-C2' 108.561 2.237 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . 0.416 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.217 0 O5'-C5'-C4' 113.332 2.237 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.418 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.164 0 O4'-C4'-C3' 107.854 2.254 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.418 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.041 0 O5'-C5'-C4' 113.255 2.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . 0.501 ' C6 ' ' N6 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.272 0 O5'-C5'-C4' 113.418 2.298 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.998 0 O4'-C4'-C3' 107.813 2.213 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C4'-C3' 107.462 1.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.314 0 O4'-C4'-C3' 107.975 2.375 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.819 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.949 0 O4'-C1'-C2' 109.047 2.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.382 0 O4'-C1'-C2' 108.73 2.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.515 " H4'" HE21 ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.529 2.303 0 O5'-C5'-C4' 112.905 1.932 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.41 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O5'-C5'-C4' 113.771 2.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.555 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.528 2.172 0 O4'-C4'-C3' 107.818 2.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.714 ' P ' HH22 ' A' ' 130' ' ' ARG . . . . . . . . 0 C5'--C4' 1.528 2.097 0 O5'-C5'-C4' 113.307 2.219 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.983 0 O5'-C5'-C4' 113.578 2.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . 0.416 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.911 0 O5'-C5'-C4' 113.486 2.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.91 0 O4'-C1'-C2' 108.774 2.431 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.238 0 O5'-C5'-C4' 113.508 2.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.091 0 O4'-C4'-C3' 107.571 1.971 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.512 0 O4'-C4'-C3' 107.776 2.176 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -1.835 0 O4'-C4'-C3' 107.921 2.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O4'-C4'-C3' 107.99 2.39 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C4'-C3' 107.615 2.015 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -111.4 83.24 1.74 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -1.104 . . . . 0.0 109.098 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -113.56 139.66 48.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 109.12 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -55.24 -34.32 63.91 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 109.603 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.55 -45.45 90.47 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.056 -1.027 . . . . 0.0 109.417 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -57.69 -47.83 81.23 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.224 -0.923 . . . . 0.0 109.975 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.866 ' O ' HG12 ' A' ' 13' ' ' VAL . 35.4 mt-30 -67.22 -36.38 81.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.194 -0.941 . . . . 0.0 109.261 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.83 -47.66 51.36 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.334 -0.854 . . . . 0.0 109.052 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -62.29 -41.56 98.6 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.156 -0.965 . . . . 0.0 109.6 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -65.78 -51.14 61.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.948 . . . . 0.0 110.47 -179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.866 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.3 p -70.92 -37.05 66.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 120.989 -1.07 . . . . 0.0 109.845 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.608 HH11 ' CG ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -61.39 -38.37 86.82 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 119.926 -1.734 . . . . 0.0 108.03 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -30.23 66.24 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.466 HD11 HD22 ' A' ' 46' ' ' LEU . 13.4 mt -69.37 -39.55 77.97 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.459 -0.775 . . . . 0.0 111.358 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.461 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -76.15 -35.44 59.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.375 -1.453 . . . . 0.0 110.158 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.3 mt-10 -62.21 -27.74 69.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.036 -1.04 . . . . 0.0 110.019 -177.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.492 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 29.9 mt -39.72 -41.01 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 121.7 -0.625 . . . . 0.0 110.346 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.492 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.8 m120 -170.32 157.87 6.38 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.07 -1.019 . . . . 0.0 109.341 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 58.4 p30 -94.15 63.25 3.11 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -98.3 144.28 27.8 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.165 -0.959 . . . . 0.0 108.942 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.25 -60.57 0.06 OUTLIER 'Trans proline' 0 C--N 1.312 -1.356 0 C-N-CA 122.164 1.909 . . . . 0.0 111.771 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' N ' ' HD2' ' A' ' 24' ' ' LYS . 4.7 mptp? -61.33 -36.1 79.23 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.307 -0.87 . . . . 0.0 109.493 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.597 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.3 ttt-85 -57.99 -45.98 85.92 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.978 -1.076 . . . . 0.0 109.192 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -61.46 -56.82 15.93 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.223 -0.923 . . . . 0.0 109.458 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.9 tt0 -51.75 -35.25 42.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.498 -0.751 . . . . 0.0 109.585 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -63.17 -62.3 1.79 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 110.655 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.53 HD11 ' NH1' ' A' ' 25' ' ' ARG . 62.8 mt -53.23 -46.82 69.29 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.288 -0.882 . . . . 0.0 109.322 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.461 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 66.1 m-20 -61.27 -46.91 88.4 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.086 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.403 -0.81 . . . . 0.0 110.067 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.621 HD23 HD13 ' A' ' 56' ' ' LEU . 63.5 tp -59.04 -50.06 75.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.028 -1.045 . . . . 0.0 110.733 -178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -63.06 -35.51 80.5 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.357 -1.337 . . . . 0.0 107.796 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 t -68.25 -52.52 32.99 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.522 -0.736 . . . . 0.0 109.702 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.61 -42.52 88.38 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.506 -0.746 . . . . 0.0 110.378 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.516 ' CE ' ' O ' ' A' ' 41' ' ' THR . 61.6 mmm -60.13 -38.59 83.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.478 -0.764 . . . . 0.0 111.027 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -57.7 -37.06 72.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.658 -1.276 . . . . 0.0 108.833 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.407 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -67.36 -47.88 69.12 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.338 -0.851 . . . . 0.0 109.832 179.607 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 39' ' ' ARG . 2.6 mmm-85 -63.63 -22.59 66.98 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.21 -0.931 . . . . 0.0 110.798 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.24 2.81 61.94 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.516 ' O ' ' CE ' ' A' ' 36' ' ' MET . 60.0 p -116.4 83.64 13.49 Favored Pre-proline 0 N--CA 1.491 1.6 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -85.32 143.81 8.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.877 2.385 . . . . 0.0 111.196 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.7 mt -82.87 103.45 10.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 O-C-N 120.841 -1.162 . . . . 0.0 109.818 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.48 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 90.7 m-20 -67.37 -55.82 12.2 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 179.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.583 ' CG ' HH11 ' A' ' 45' ' ' ARG . 0.1 OUTLIER -127.31 133.64 50.09 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.177 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.466 HD22 HD11 ' A' ' 16' ' ' LEU . 11.0 mt -70.91 146.35 92.97 Favored Pre-proline 0 C--N 1.3 -1.571 0 O-C-N 121.074 -1.016 . . . . 0.0 109.59 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -70.27 132.17 21.97 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.536 1.491 . . . . 0.0 108.967 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.563 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 9.0 mt -99.55 141.4 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 120.771 -1.206 . . . . 0.0 109.917 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 82.3 mtp -140.78 121.19 14.03 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 72.05 39.76 0.78 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.6 mttm 59.41 20.57 8.9 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.257 0.551 . . . . 0.0 110.161 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -139.74 159.35 42.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.093 -1.005 . . . . 0.0 109.395 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.15 146.35 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.985 -1.072 . . . . 0.0 109.414 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.7 HD21 HD22 ' A' ' 59' ' ' LEU . 57.7 tp -78.29 124.8 28.5 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.197 -0.94 . . . . 0.0 108.936 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.17 98.41 0.14 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.692 -0.63 . . . . 0.0 110.449 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.621 HD13 HD23 ' A' ' 32' ' ' LEU . 55.8 mt -56.16 -28.0 56.41 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.97 -1.081 . . . . 0.0 108.566 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -77.68 -60.77 2.23 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.178 -0.951 . . . . 0.0 111.825 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.7 -37.87 74.25 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.778 -1.201 . . . . 0.0 109.257 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.7 HD22 HD21 ' A' ' 54' ' ' LEU . 52.1 tp -58.35 -47.22 84.49 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CE2' HG13 ' A' ' 64' ' ' ILE . 48.8 t80 -62.13 -66.91 0.47 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.674 -0.641 . . . . 0.0 110.072 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 60' ' ' TYR . 58.1 t30 -40.02 -40.86 1.12 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.537 -0.727 . . . . 0.0 111.21 -178.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 mt -73.97 -46.67 42.48 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.031 -1.467 . . . . 0.0 108.023 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.777 HG21 ' CE2' ' A' ' 102' ' ' TYR . 37.3 t -53.97 -44.15 60.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.001 -1.062 . . . . 0.0 109.833 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.401 HG13 ' CE2' ' A' ' 60' ' ' TYR . 7.3 mm -68.22 -36.47 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 120.685 -1.259 . . . . 0.0 107.794 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.82 -15.64 22.28 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.669 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.688 HH21 ' CB ' ' A' ' 80' ' ' GLU . 18.1 mmt-85 -98.27 1.71 47.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.346 -1.471 . . . . 0.0 108.554 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.31 13.01 74.77 Favored Glycine 0 N--CA 1.49 2.239 0 C-N-CA 120.42 -0.895 . . . . 0.0 111.572 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.87 137.29 3.73 Favored Glycine 0 N--CA 1.504 3.193 0 O-C-N 120.532 -1.569 . . . . 0.0 111.901 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.531 HD11 ' HH2' ' A' ' 78' ' ' TRP . 8.6 tp -51.85 -41.72 62.04 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.756 -0.85 . . . . 0.0 110.29 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 122' ' ' LEU . 93.2 t -57.78 -43.72 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.009 -1.057 . . . . 0.0 109.413 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 -57.07 -40.48 76.96 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.067 -1.021 . . . . 0.0 109.238 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.602 ' O ' ' N ' ' A' ' 76' ' ' LYS . 50.8 t -61.83 -43.41 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.45 -0.781 . . . . 0.0 109.916 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -58.55 6.34 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 O-C-N 120.711 -1.243 . . . . 0.0 110.394 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -57.74 -41.05 81.08 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.147 -0.971 . . . . 0.0 110.667 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -93.46 -9.81 37.2 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.081 -1.012 . . . . 0.0 110.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 72' ' ' VAL . 19.2 mtmt 59.07 59.36 2.79 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.289 -0.882 . . . . 0.0 109.643 -178.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.2 mt -93.95 15.58 16.49 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.89 -1.131 . . . . 0.0 108.592 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.531 ' HH2' HD11 ' A' ' 69' ' ' LEU . 86.9 m95 -63.02 -41.68 99.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.358 -0.838 . . . . 0.0 108.924 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.0 mt-30 -48.86 -39.11 24.45 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 120.519 -1.363 . . . . 0.0 108.442 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.688 ' CB ' HH21 ' A' ' 66' ' ' ARG . 73.7 mm-40 -66.32 -38.65 88.19 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 78' ' ' TRP . 6.1 mt -75.26 -52.2 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 0.0 109.09 178.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.588 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.0 mt -51.25 -53.77 13.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.323 -0.861 . . . . 0.0 109.03 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -69.75 -38.71 76.9 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.27 -0.894 . . . . 0.0 109.334 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.43 -34.36 48.69 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 88.7 mt -86.68 -8.71 57.19 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.445 -1.033 . . . . 0.0 108.587 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 64.29 40.36 6.67 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.758 -0.589 . . . . 0.0 109.901 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -74.61 143.67 79.3 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 108.996 178.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 50' ' ' ALA . 37.4 Cg_endo -70.2 143.3 48.3 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 121.982 1.788 . . . . 0.0 111.597 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p -60.23 1.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.892 . . . . 0.0 110.162 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 88' ' ' PRO . 91.4 p -66.43 -22.2 66.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.162 -0.962 . . . . 0.0 110.062 -178.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.547 HD11 ' H ' ' A' ' 50' ' ' ALA . 65.4 mt -100.11 106.18 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.927 -1.108 . . . . 0.0 109.346 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.7 p -78.56 -25.33 45.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.181 -0.949 . . . . 0.0 108.714 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -93.88 32.36 1.47 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' O ' ' C ' ' A' ' 95' ' ' ALA . . . -63.77 -65.5 0.67 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.32 -0.863 . . . . 0.0 109.096 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -47.33 -52.14 17.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.99 -1.069 . . . . 0.0 108.99 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.454 ' O ' ' OG1' ' A' ' 100' ' ' THR . 8.4 tp -58.03 -44.76 87.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.097 -1.002 . . . . 0.0 109.191 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.3 m -61.78 -39.67 92.5 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.089 -1.007 . . . . 0.0 108.758 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 95' ' ' ALA . 11.2 mt -67.44 -45.16 76.87 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.511 -0.743 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 tmm_? -68.93 -49.24 59.81 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.139 -0.976 . . . . 0.0 111.219 -179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 0.6 OUTLIER -55.01 -54.42 43.2 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 120.913 -1.117 . . . . 0.0 109.565 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -63.42 -42.38 98.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.097 -1.002 . . . . 0.0 111.777 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.777 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.6 t80 -57.13 -42.73 81.47 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.162 -1.586 . . . . 0.0 109.142 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.758 ' SD ' HD11 ' A' ' 126' ' ' ILE . 84.7 mtp -54.41 -56.21 20.94 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.623 -0.673 . . . . 0.0 112.337 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -71.4 -48.89 46.97 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.28 -1.512 . . . . 0.0 112.392 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.516 ' C ' HD12 ' A' ' 106' ' ' LEU . 70.2 m-85 -86.29 -52.35 5.69 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -174.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.751 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.0 mp -98.0 12.15 35.2 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.287 -1.508 . . . . 0.0 113.74 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.569 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 55.2 t80 -66.89 -37.15 13.15 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 119.93 -1.731 . . . . 0.0 111.638 -179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 73.7 Cg_endo -82.47 -38.75 0.17 Allowed 'Trans proline' 0 C--N 1.315 -1.224 0 C-N-CA 121.705 1.604 . . . . 0.0 112.532 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -58.7 -41.39 86.19 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -72.02 -49.34 37.69 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.569 -0.707 . . . . 0.0 109.926 179.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.564 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.8 OUTLIER -73.82 -45.48 51.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.324 -0.86 . . . . 0.0 110.891 -178.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.43 -47.77 72.15 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.057 -1.027 . . . . 0.0 110.905 -178.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 22.0 mmtp -77.02 -27.33 54.54 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 120.978 -1.076 . . . . 0.0 111.333 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.483 ' HG2' HD21 ' A' ' 116' ' ' LEU . 22.8 tptp -125.3 -29.27 3.28 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 120.9 -1.125 . . . . 0.0 111.536 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 111' ' ' CYS . 61.6 t30 59.45 45.13 14.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.59 -1.319 . . . . 0.0 109.987 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.483 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.5 mt -67.82 -33.63 75.16 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.301 -0.875 . . . . 0.0 111.211 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.547 ' OG ' ' N ' ' A' ' 118' ' ' THR . 28.8 t -154.28 -166.98 2.49 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.707 -1.197 . . . . 0.0 111.627 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.547 ' N ' ' OG ' ' A' ' 117' ' ' SER . 77.9 p -128.45 163.36 45.08 Favored Pre-proline 0 N--CA 1.498 1.934 0 O-C-N 121.795 -0.566 . . . . 0.0 109.86 -178.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.413 ' CD ' ' OH ' ' A' ' 107' ' ' TYR . 35.9 Cg_exo -59.7 -40.31 65.71 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 121.763 1.642 . . . . 0.0 112.404 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.08 -37.94 89.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.825 -1.172 . . . . 0.0 109.665 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.406 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -67.0 -44.92 79.13 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.692 HD21 ' HG2' ' A' ' 103' ' ' MET . 19.1 tp -66.51 -53.19 37.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.597 -0.69 . . . . 0.0 110.275 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -56.18 -46.55 79.34 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 108.982 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.79 -39.31 88.4 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.468 -0.77 . . . . 0.0 109.77 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.14 -34.51 76.48 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.233 -0.917 . . . . 0.0 108.664 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.758 HD11 ' SD ' ' A' ' 103' ' ' MET . 16.9 mt -65.01 -49.48 79.42 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.89 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -62.08 -37.94 86.93 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.44 -32.72 85.15 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.622 HD22 ' C ' ' A' ' 129' ' ' ASN . 0.1 OUTLIER -93.94 -33.51 13.44 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.805 -1.409 . . . . 0.0 110.592 -179.017 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.617 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 54.6 mtp180 -63.04 143.78 57.47 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.748 -1.22 . . . . 0.0 109.616 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.506 HH11 ' HG2' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -60.09 154.49 19.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.833 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -87.27 107.11 18.35 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.093 -1.005 . . . . 0.0 109.793 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.424 -1.471 . . . . 0.0 109.424 179.754 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.403 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.424 -1.974 0 O4'-C1'-C2' 108.202 1.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.526 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.923 0 O4'-C1'-C2' 108.503 2.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.869 0 O4'-C4'-C3' 107.345 1.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.181 0 O4'-C4'-C3' 107.77 2.17 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.146 0 O5'-C5'-C4' 113.152 2.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.349 0 O5'-C5'-C4' 113.311 2.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.232 0 O5'-C5'-C4' 112.924 1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.563 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.606 1.339 0 C4'-C3'-C2' 105.296 2.096 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.042 0 O5'-C5'-C4' 113.254 2.181 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.109 0 O5'-C5'-C4' 113.367 2.262 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.955 0 O5'-C5'-C4' 113.032 2.023 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . 0.403 ' C6 ' ' N6 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.977 0 O5'-C5'-C4' 113.143 2.102 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.732 0 O4'-C4'-C3' 107.766 2.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.827 0 O4'-C4'-C3' 107.277 1.677 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.89 0 O4'-C4'-C3' 107.941 2.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.463 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.244 0 O4'-C1'-C2' 107.806 1.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.444 0 O4'-C1'-C2' 108.748 2.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.467 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.255 0 O5'-C5'-C4' 112.487 1.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.467 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 P--O5' 1.609 1.59 0 O5'-C5'-C4' 113.62 2.443 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.464 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C4'-C3' 107.681 2.081 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.587 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O5'-C5'-C4' 113.428 2.306 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.587 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.993 0 O5'-C5'-C4' 113.452 2.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.767 0 O5'-C5'-C4' 113.389 2.278 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.305 0 O5'-C5'-C4' 113.524 2.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.059 0 O4'-C4'-C3' 108.023 2.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O4'-C4'-C3' 107.71 2.11 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.773 0 O4'-C4'-C3' 107.802 2.202 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.903 0 O5'-C5'-C4' 113.065 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.141 0 O5'-C5'-C4' 113.041 2.029 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.853 0 O4'-C4'-C3' 107.462 1.862 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.376 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 28.3 p90 -67.05 152.02 46.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.218 -1.166 . . . . 0.0 109.624 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.69 141.05 29.63 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.323 -0.86 . . . . 0.0 109.543 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -54.96 -38.82 68.23 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.452 -0.78 . . . . 0.0 110.755 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -62.5 -42.0 99.21 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.834 -1.166 . . . . 0.0 109.179 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -56.07 -40.34 73.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.298 -0.876 . . . . 0.0 109.24 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.708 ' O ' HG13 ' A' ' 13' ' ' VAL . 45.9 mm-40 -72.65 -37.27 68.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.185 -0.947 . . . . 0.0 109.879 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CE1' ' NE ' ' A' ' 14' ' ' ARG . 84.6 t80 -58.75 -52.54 65.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.213 -0.93 . . . . 0.0 109.733 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -61.5 -47.11 87.11 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.272 -0.893 . . . . 0.0 109.889 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.438 ' O ' HD11 ' A' ' 46' ' ' LEU . 90.4 mt-30 -63.85 -50.42 68.93 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.418 -0.801 . . . . 0.0 110.896 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.708 HG13 ' O ' ' A' ' 9' ' ' GLN . 3.4 m -69.48 -34.61 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 120.61 -1.306 . . . . 0.0 108.595 179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.64 ' NE ' ' CE1' ' A' ' 10' ' ' PHE . 13.1 mmt180 -62.68 -39.95 95.56 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.512 -1.367 . . . . 0.0 107.787 178.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.71 -26.02 55.83 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.496 ' CD1' HD13 ' A' ' 46' ' ' LEU . 7.7 mt -78.66 -37.59 41.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.536 -0.727 . . . . 0.0 111.835 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.42 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -79.35 -31.08 42.94 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.389 -1.445 . . . . 0.0 110.468 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -63.61 -29.81 71.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.882 -1.136 . . . . 0.0 109.639 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.513 HD13 HH22 ' A' ' 25' ' ' ARG . 56.9 mt -43.07 -45.47 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 O-C-N 121.571 -0.705 . . . . 0.0 110.248 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.821 HD21 HH11 ' A' ' 25' ' ' ARG . 0.0 OUTLIER 179.98 125.46 0.07 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.238 -0.914 . . . . 0.0 108.618 178.029 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -82.21 78.1 8.93 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 111.416 -177.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -98.01 124.23 48.36 Favored Pre-proline 0 N--CA 1.489 1.487 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 178.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -36.39 -57.52 0.58 Allowed 'Trans proline' 0 C--N 1.313 -1.295 0 C-N-CA 122.208 1.938 . . . . 0.0 113.22 -178.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 tptm -62.78 -42.07 99.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.047 -1.033 . . . . 0.0 110.76 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.821 HH11 HD21 ' A' ' 20' ' ' ASN . 60.7 ttt180 -60.67 -45.13 95.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.809 -1.182 . . . . 0.0 111.678 -178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -59.89 -51.18 70.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.37 -1.456 . . . . 0.0 108.701 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -54.68 -36.46 64.67 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -59.11 -66.04 0.57 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.277 -0.889 . . . . 0.0 110.221 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HB3' ' A' ' 16' ' ' LEU . 50.8 mt -55.95 -43.0 77.04 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-O 121.495 0.664 . . . . 0.0 109.535 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -60.36 -50.25 74.34 Favored 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.305 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -66.98 -43.56 82.71 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.227 -0.921 . . . . 0.0 109.838 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.456 ' O ' ' CG ' ' A' ' 36' ' ' MET . 46.9 tp -54.69 -54.07 46.62 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.336 -0.853 . . . . 0.0 110.198 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -63.34 -33.64 75.97 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 120.594 -1.316 . . . . 0.0 108.424 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.6 t -69.81 -63.19 1.12 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.618 -0.676 . . . . 0.0 111.271 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.467 ' CZ ' ' OE1' ' A' ' 112' ' ' GLU . 0.6 OUTLIER -62.01 -32.09 72.54 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.111 -0.993 . . . . 0.0 110.723 -178.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.456 ' CG ' ' O ' ' A' ' 32' ' ' LEU . 62.2 mmm -59.43 -34.92 73.1 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.985 -1.072 . . . . 0.0 109.866 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -61.59 -40.15 93.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.242 -0.911 . . . . 0.0 110.321 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -58.43 -48.08 81.87 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.474 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.3 OUTLIER -63.71 -21.93 66.65 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.385 -0.822 . . . . 0.0 110.559 -178.35 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.62 7.43 60.26 Favored Glycine 0 N--CA 1.481 1.643 0 N-CA-C 107.837 -2.105 . . . . 0.0 107.837 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 p -117.89 85.2 22.33 Favored Pre-proline 0 N--CA 1.492 1.641 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -93.73 146.72 2.13 Favored 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 123.346 2.697 . . . . 0.0 112.154 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 80.2 mt -79.22 95.59 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 109.535 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.601 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 19.6 m120 -59.37 -28.58 67.0 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -160.64 138.22 9.44 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.496 HD13 ' CD1' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -71.69 145.2 89.43 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 120.976 -1.078 . . . . 0.0 108.544 -179.365 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -66.77 131.34 25.51 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.235 1.29 . . . . 0.0 109.215 177.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.541 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 8.9 mt -97.39 143.31 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 120.903 -1.123 . . . . 0.0 110.126 -178.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.687 ' SD ' HD13 ' A' ' 54' ' ' LEU . 75.1 mtp -138.98 121.92 16.66 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 67.78 40.56 2.4 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.1 mttm 57.17 24.24 9.54 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.47 0.652 . . . . 0.0 109.459 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.2 m -135.43 153.42 51.79 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.38 -0.825 . . . . 0.0 109.144 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 m -70.44 146.64 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.055 -1.028 . . . . 0.0 109.328 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.687 HD13 ' SD ' ' A' ' 49' ' ' MET . 48.4 tp -79.14 123.8 27.72 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.402 -0.811 . . . . 0.0 110.445 -178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -65.49 88.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 56' ' ' LEU . 19.3 mt -54.42 -24.1 18.56 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 120.995 -1.066 . . . . 0.0 109.552 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.502 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 41.7 t80 -82.29 -56.6 3.81 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 111.735 -178.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.54 -38.49 81.16 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.531 -1.356 . . . . 0.0 109.321 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.467 HD22 HD21 ' A' ' 54' ' ' LEU . 53.6 tp -57.46 -46.49 83.59 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.436 ' CE2' HG13 ' A' ' 64' ' ' ILE . 46.3 t80 -56.98 -64.58 0.83 Allowed 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.624 ' N ' HD22 ' A' ' 61' ' ' ASN . 1.4 m120 -44.3 -40.16 5.06 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.389 -0.819 . . . . 0.0 111.128 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 66' ' ' ARG . 6.9 mt -72.07 -44.34 63.46 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 118.085 -1.446 . . . . 0.0 107.518 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.744 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -60.09 -44.49 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.436 HG13 ' CE2' ' A' ' 60' ' ' TYR . 12.3 mm -67.91 -36.5 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.467 -1.396 . . . . 0.0 107.981 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.452 ' HB3' HH11 ' A' ' 66' ' ' ARG . . . -56.4 -20.84 21.39 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.174 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.608 HH21 ' CB ' ' A' ' 80' ' ' GLU . 9.9 mpt_? -93.41 1.5 56.85 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.596 -1.315 . . . . 0.0 109.304 179.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.89 15.29 75.56 Favored Glycine 0 N--CA 1.491 2.357 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.014 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.73 2.97 Favored Glycine 0 N--CA 1.498 2.816 0 O-C-N 120.463 -1.61 . . . . 0.0 111.309 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.562 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.6 tp -48.45 -38.13 19.05 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.71 -0.876 . . . . 0.0 110.785 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.454 HG22 ' HA ' ' A' ' 122' ' ' LEU . 97.0 t -57.95 -41.74 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 120.846 -1.159 . . . . 0.0 110.476 -178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -58.78 -37.6 76.64 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.97 . . . . 0.0 109.914 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' LYS . 21.2 t -66.13 -42.5 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.093 -1.004 . . . . 0.0 110.643 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.408 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 48.3 mt -69.48 -57.92 7.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 120.828 -1.17 . . . . 0.0 110.548 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.406 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 92.8 m-20 -58.01 -41.53 83.33 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.047 -1.033 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -92.4 -7.98 46.15 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.261 -0.899 . . . . 0.0 110.428 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.7 mttp 58.12 55.69 5.03 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.309 -0.87 . . . . 0.0 110.592 -179.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.467 HD13 ' CG ' ' A' ' 66' ' ' ARG . 11.1 mt -90.61 12.45 18.86 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.699 -1.25 . . . . 0.0 107.835 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.562 ' CH2' HD11 ' A' ' 69' ' ' LEU . 98.3 m95 -62.31 -41.34 98.46 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mm100 -48.86 -37.71 20.33 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.737 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.608 ' CB ' HH21 ' A' ' 66' ' ' ARG . 93.3 mt-10 -69.62 -40.82 76.35 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.8 mt -67.49 -53.51 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.489 HD11 ' HB2' ' A' ' 95' ' ' ALA . 62.6 mt -51.27 -57.65 2.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.299 -0.876 . . . . 0.0 109.266 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -66.83 -37.4 84.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.153 -0.967 . . . . 0.0 109.467 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.91 -37.59 58.21 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.71 -8.71 58.75 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.329 -1.101 . . . . 0.0 108.17 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 69.0 41.16 1.48 Allowed 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.236 0.541 . . . . 0.0 110.844 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.7 mt -73.4 148.44 88.23 Favored Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.196 -0.94 . . . . 0.0 108.789 177.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.29 170.25 18.75 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.301 2.001 . . . . 0.0 112.282 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.5 t -79.55 -1.74 39.16 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.46 -0.775 . . . . 0.0 109.4 179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 24.4 m -65.06 -33.97 77.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.504 -0.748 . . . . 0.0 110.652 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.532 HD11 ' H ' ' A' ' 50' ' ' ALA . 86.0 mt -92.76 98.89 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 120.637 -1.289 . . . . 0.0 109.263 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 31.9 p -72.21 -30.49 64.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.077 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.4 m -97.5 45.19 1.03 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.496 -0.752 . . . . 0.0 109.43 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -59.55 3.34 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.113 -0.992 . . . . 0.0 108.868 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.489 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.18 -50.55 15.57 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.197 -0.939 . . . . 0.0 109.633 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.466 ' O ' ' OG1' ' A' ' 100' ' ' THR . 7.4 tp -58.19 -43.75 87.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.681 -1.262 . . . . 0.0 109.023 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.1 m -62.5 -40.76 97.77 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.055 -1.028 . . . . 0.0 108.822 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 95' ' ' ALA . 9.3 mt -69.3 -42.87 74.87 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.562 -0.711 . . . . 0.0 110.252 -179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.764 ' NH1' HD21 ' A' ' 129' ' ' ASN . 46.4 ttp180 -69.24 -50.11 50.11 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.155 -0.966 . . . . 0.0 110.859 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -54.31 -54.58 38.36 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.026 -1.046 . . . . 0.0 109.419 -179.015 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -62.86 -41.19 99.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.16 -0.962 . . . . 0.0 111.468 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.744 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.5 t80 -58.16 -43.93 87.65 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 119.826 -1.796 . . . . 0.0 109.153 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.658 ' HG2' HD21 ' A' ' 122' ' ' LEU . 86.3 mtp -51.96 -56.52 13.69 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.78 -0.575 . . . . 0.0 112.097 -178.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.1 mttm -73.48 -51.08 18.38 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.517 -1.364 . . . . 0.0 112.553 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.53 ' C ' HD12 ' A' ' 106' ' ' LEU . 69.7 m-85 -85.49 -48.1 9.28 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -174.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.8 mp -97.5 -1.51 43.93 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.23 -1.544 . . . . 0.0 113.433 -176.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.656 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 66.2 t80 -64.15 -36.06 18.06 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 119.865 -1.772 . . . . 0.0 109.709 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 10.6 Cg_exo -66.81 -51.73 0.83 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 C-N-CA 121.801 1.667 . . . . 0.0 111.213 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -58.03 -50.29 73.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.233 -0.917 . . . . 0.0 109.271 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.45 ' OE1' ' CE1' ' A' ' 102' ' ' TYR . 85.9 tt0 -65.67 -43.94 87.76 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.296 -0.878 . . . . 0.0 110.843 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.3 -45.31 18.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.983 . . . . 0.0 110.422 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 108' ' ' PRO . 32.0 tt0 -67.65 -51.87 44.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.269 -0.894 . . . . 0.0 111.417 -178.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -75.33 -29.62 60.03 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -0.97 . . . . 0.0 111.961 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.504 ' HG2' HD21 ' A' ' 116' ' ' LEU . 21.5 tptp -123.33 -28.92 3.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.972 -1.08 . . . . 0.0 111.852 -177.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 30.0 t30 57.86 46.02 17.51 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.742 -1.224 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.504 HD21 ' HG2' ' A' ' 114' ' ' LYS . 93.7 mt -65.86 -31.79 72.94 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 120.917 -1.114 . . . . 0.0 110.94 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.595 ' OG ' ' N ' ' A' ' 118' ' ' THR . 10.7 t -153.91 -167.01 2.53 Favored 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 119.001 -1.08 . . . . 0.0 111.192 -178.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.595 ' N ' ' OG ' ' A' ' 117' ' ' SER . 53.9 p -129.35 155.55 79.86 Favored Pre-proline 0 N--CA 1.5 2.054 0 O-C-N 121.474 -0.766 . . . . 0.0 110.583 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -49.91 -43.19 42.37 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 122.106 1.871 . . . . 0.0 112.42 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.14 88.58 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.789 -1.194 . . . . 0.0 109.371 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.442 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.1 mt-10 -65.97 -45.61 81.08 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 103' ' ' MET . 44.2 tp -66.54 -53.42 35.04 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.644 -0.66 . . . . 0.0 110.415 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -56.03 -45.04 79.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.775 -1.203 . . . . 0.0 109.128 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.27 96.67 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.461 -0.775 . . . . 0.0 110.333 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.406 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.31 -35.79 78.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.165 -0.959 . . . . 0.0 108.686 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.528 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 24.3 mt -64.77 -48.04 86.14 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 CA-C-O 121.536 0.684 . . . . 0.0 109.189 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -65.71 -36.93 85.02 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.045 -1.034 . . . . 0.0 108.967 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -63.4 -32.88 85.65 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.764 HD21 ' NH1' ' A' ' 99' ' ' ARG . 10.9 p-10 -94.02 -31.52 14.2 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.886 -1.361 . . . . 0.0 110.305 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.623 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 48.3 mtp180 -64.27 144.33 57.23 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.926 -1.109 . . . . 0.0 109.948 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -68.81 154.16 42.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.587 -0.696 . . . . 0.0 110.132 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -111.17 -152.66 0.5 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.901 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -1.898 0 O4'-C1'-C2' 108.525 2.205 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.521 0 O4'-C1'-C2' 108.417 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.891 0 O4'-C4'-C3' 107.492 1.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.446 0 O5'-C5'-C4' 113.504 2.36 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.995 0 O5'-C5'-C4' 113.073 2.052 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.301 0 O5'-C5'-C4' 113.427 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.796 0 O5'-C5'-C4' 112.743 1.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.541 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.202 0 O4'-C4'-C3' 107.816 2.216 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.448 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.448 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.071 0 O5'-C5'-C4' 113.365 2.261 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.448 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.018 0 O5'-C5'-C4' 113.277 2.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.874 0 O4'-C4'-C3' 107.905 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.845 0 O4'-C4'-C3' 108.0 2.4 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.88 0 O4'-C4'-C3' 107.733 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.207 0 O4'-C4'-C3' 107.883 2.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.784 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.871 0 O4'-C1'-C2' 108.973 2.612 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.556 0 C4'-C3'-C2' 105.645 2.445 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.086 0 O5'-C5'-C4' 112.913 1.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.322 0 C4'-C3'-C2' 105.694 2.494 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.426 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.774 0 O4'-C4'-C3' 108.082 2.482 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.421 ' C7 ' ' CD2' ' A' ' 96' ' ' LEU . . . . . . . . 0 P--O5' 1.609 1.626 0 O4'-C4'-C3' 107.763 2.163 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.007 0 O5'-C5'-C4' 113.47 2.336 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O5'-C5'-C4' 113.493 2.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.194 0 O5'-C5'-C4' 113.17 2.121 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.94 0 O5'-C5'-C4' 113.5 2.357 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.148 0 O4'-C4'-C3' 107.694 2.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.24 0 O4'-C4'-C3' 107.828 2.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O5'-C5'-C4' 112.866 1.904 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.268 0 O4'-C4'-C3' 107.963 2.363 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.251 0 C1'-O4'-C4' 106.513 -2.276 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -115.56 80.47 1.44 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.411 -1.052 . . . . 0.0 109.276 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.84 143.81 43.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.331 -0.856 . . . . 0.0 109.635 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -55.94 -43.01 77.03 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.404 -0.81 . . . . 0.0 110.456 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -64.86 -40.13 94.65 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.628 -1.295 . . . . 0.0 110.2 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -59.68 -44.35 93.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.248 -0.908 . . . . 0.0 111.373 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.937 ' O ' HG12 ' A' ' 13' ' ' VAL . 33.5 mt-30 -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.83 -1.169 . . . . 0.0 110.262 -179.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -55.54 -45.96 77.17 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.927 -1.108 . . . . 0.0 109.0 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -61.32 -41.34 96.84 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.651 -0.819 . . . . 0.0 108.821 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -66.32 -53.22 38.93 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.42 -0.8 . . . . 0.0 111.378 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.937 HG12 ' O ' ' A' ' 9' ' ' GLN . 2.0 p -70.04 -35.49 64.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.084 -1.01 . . . . 0.0 110.688 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HG2' HH11 ' A' ' 14' ' ' ARG . 1.1 tpt180 -62.18 -36.08 80.78 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 119.761 -1.837 . . . . 0.0 107.864 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -59.32 -32.58 70.2 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HA ' HD12 ' A' ' 19' ' ' ILE . 8.2 mt -63.03 -39.12 93.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.345 -0.847 . . . . 0.0 110.648 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 98.1 m-85 -80.46 -36.31 33.71 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.565 -1.335 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' OE2' ' NH2' ' A' ' 14' ' ' ARG . 76.5 mm-40 -65.23 -30.05 70.9 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.903 -1.123 . . . . 0.0 111.024 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.687 HG21 HH12 ' A' ' 25' ' ' ARG . 15.5 mt -38.13 -39.01 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 O-C-N 121.506 -0.746 . . . . 0.0 111.061 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -170.3 163.11 8.75 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.563 -1.336 . . . . 0.0 110.785 -179.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -90.04 67.06 6.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.775 -0.578 . . . . 0.0 110.494 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.408 ' OD1' ' C ' ' A' ' 22' ' ' ASP . 51.7 t0 -111.98 99.46 45.78 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -49.62 -47.62 22.2 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.392 2.061 . . . . 0.0 112.845 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -37.65 80.14 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.035 -1.041 . . . . 0.0 108.951 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.687 HH12 HG21 ' A' ' 19' ' ' ILE . 66.0 ttt180 -60.34 -36.82 78.85 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.263 -0.898 . . . . 0.0 109.46 179.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -59.57 -50.46 73.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.189 -0.945 . . . . 0.0 109.177 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -53.41 -36.92 62.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 109.288 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.72 -61.72 2.22 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.51 -0.744 . . . . 0.0 110.926 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 65.1 mt -53.75 -48.21 69.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.449 -0.782 . . . . 0.0 110.204 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 78.6 m-20 -59.83 -51.73 68.49 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.39 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -65.92 -42.15 90.48 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.966 -1.084 . . . . 0.0 109.794 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.64 -51.26 70.23 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.006 -1.059 . . . . 0.0 110.28 -178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CE2' HG23 ' A' ' 13' ' ' VAL . 46.3 m-85 -60.21 -34.59 73.86 Favored 'General case' 0 C--N 1.301 -1.513 0 C-N-CA 118.441 -1.303 . . . . 0.0 108.01 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.6 m -67.48 -54.03 23.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.819 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -60.3 -39.48 87.1 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.178 -0.952 . . . . 0.0 109.958 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 76.4 mmm -58.72 -42.53 88.94 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.441 -0.787 . . . . 0.0 110.717 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -65.0 -35.53 81.49 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.892 -1.13 . . . . 0.0 109.726 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -59.0 -53.45 58.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.213 -0.929 . . . . 0.0 109.722 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.477 HH11 ' HB3' ' A' ' 108' ' ' PRO . 25.7 mtp180 -64.53 -18.04 64.47 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.503 -0.748 . . . . 0.0 111.626 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.57 5.09 60.37 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 107.817 -2.113 . . . . 0.0 107.817 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.9 p -115.62 83.74 11.58 Favored Pre-proline 0 N--CA 1.493 1.719 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -87.12 146.44 7.63 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.898 2.398 . . . . 0.0 111.286 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 mt -80.96 99.11 4.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 120.869 -1.144 . . . . 0.0 109.185 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.503 ' CB ' HH21 ' A' ' 45' ' ' ARG . 92.7 m-20 -64.99 -49.84 68.69 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.148 -0.97 . . . . 0.0 109.108 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.503 HH21 ' CB ' ' A' ' 44' ' ' ASN . 7.7 mtm180 -135.56 137.26 41.84 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.305 -0.872 . . . . 0.0 108.832 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 16' ' ' LEU . 17.9 mt -71.9 141.96 84.98 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 120.951 -1.093 . . . . 0.0 109.368 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -71.16 108.16 2.28 Favored 'Trans proline' 0 C--N 1.308 -1.597 0 C-N-CA 121.483 1.455 . . . . 0.0 109.785 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.597 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 49.9 mt -76.92 143.22 13.24 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 110.298 -178.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.604 ' SD ' HG21 ' A' ' 97' ' ' THR . 28.8 mmm -137.55 124.63 21.54 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 63.09 41.08 8.47 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -178.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 60.6 mttp 60.5 23.03 12.69 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.982 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.52 ' N ' HG23 ' A' ' 48' ' ' ILE . 50.9 m -136.42 153.01 51.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.102 -0.999 . . . . 0.0 109.59 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.457 HG13 ' H ' ' A' ' 53' ' ' VAL . 1.1 m -65.94 143.57 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 108.895 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.553 HD21 HD22 ' A' ' 59' ' ' LEU . 33.7 tp -75.12 122.45 23.61 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.076 -1.015 . . . . 0.0 109.554 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.04 97.16 0.08 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.423 -0.798 . . . . 0.0 109.022 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.7 mt -58.59 -27.98 65.14 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.3 -0.875 . . . . 0.0 109.138 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -80.27 -62.18 1.76 Allowed 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.863 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -55.51 -37.14 67.48 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.692 -1.255 . . . . 0.0 110.075 -178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.553 HD22 HD21 ' A' ' 54' ' ' LEU . 19.4 tp -63.11 -45.2 93.15 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.433 ' CE2' HG13 ' A' ' 64' ' ' ILE . 63.4 t80 -62.16 -66.57 0.52 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 60' ' ' TYR . 50.7 t-20 -42.54 -37.7 1.73 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.612 -0.68 . . . . 0.0 109.355 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.878 HD22 HH22 ' A' ' 66' ' ' ARG . 11.5 mt -70.36 -48.58 55.67 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 102' ' ' TYR . 30.4 t -55.58 -42.17 67.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.256 -0.903 . . . . 0.0 110.051 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.433 HG13 ' CE2' ' A' ' 60' ' ' TYR . 10.9 mm -71.16 -33.59 51.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 120.795 -1.19 . . . . 0.0 107.888 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' NH1' ' A' ' 66' ' ' ARG . . . -57.53 -19.38 24.62 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.738 -0.785 . . . . 0.0 109.56 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.878 HH22 HD22 ' A' ' 62' ' ' LEU . 13.4 mmt-85 -96.79 -3.24 42.64 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.736 -1.228 . . . . 0.0 108.273 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 13.16 71.78 Favored Glycine 0 N--CA 1.491 2.341 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.059 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.07 131.45 2.45 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.297 -1.707 . . . . 0.0 111.714 178.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.733 HD13 ' CD1' ' A' ' 102' ' ' TYR . 6.6 tp -50.2 -41.21 49.19 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.589 -0.947 . . . . 0.0 109.998 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.425 HG22 ' HA ' ' A' ' 122' ' ' LEU . 80.0 t -61.49 -43.15 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.148 -0.97 . . . . 0.0 109.732 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -55.24 -38.8 68.97 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.971 -1.08 . . . . 0.0 108.862 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.637 ' O ' ' N ' ' A' ' 76' ' ' LYS . 47.0 t -64.22 -42.55 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.653 -0.654 . . . . 0.0 109.587 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.483 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 95.1 mt -65.38 -59.06 4.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.68 0 O-C-N 121.052 -1.03 . . . . 0.0 110.679 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -58.26 -40.58 82.21 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.104 -0.998 . . . . 0.0 110.4 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.7 mmtt -93.14 -12.22 30.94 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.211 -0.931 . . . . 0.0 110.855 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.637 ' N ' ' O ' ' A' ' 72' ' ' VAL . 15.1 mtmt 59.67 62.68 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.252 -0.905 . . . . 0.0 110.102 -178.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.1 14.33 24.21 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.094 -1.004 . . . . 0.0 108.627 178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.523 ' NE1' HG12 ' A' ' 72' ' ' VAL . 81.8 m95 -63.44 -39.22 93.91 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.291 -0.881 . . . . 0.0 109.341 179.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 78' ' ' TRP . 78.4 mm-40 -49.31 -38.29 27.12 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.651 -1.281 . . . . 0.0 108.28 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.599 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.9 mm-40 -70.53 -42.2 71.54 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.427 HG12 ' NH2' ' A' ' 66' ' ' ARG . 3.7 mt -67.34 -54.73 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' A' ' 95' ' ' ALA . 58.5 mt -53.37 -53.6 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.575 -0.703 . . . . 0.0 109.973 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -65.81 -41.31 92.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.014 -1.054 . . . . 0.0 109.627 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.48 -32.72 46.08 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.2 mt -88.93 -8.48 54.1 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.379 -1.071 . . . . 0.0 108.991 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 65.32 40.8 4.64 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.66 -0.65 . . . . 0.0 109.935 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.2 mt -73.42 119.21 74.67 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.341 -0.85 . . . . 0.0 109.385 178.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.465 ' C ' ' H ' ' A' ' 90' ' ' SER . 52.0 Cg_exo -48.44 141.96 18.36 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 121.719 1.613 . . . . 0.0 112.229 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.8 p -59.58 -1.61 0.26 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.286 -0.884 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 88' ' ' PRO . 83.8 p -66.45 -22.9 66.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.168 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.521 HD13 ' SD ' ' A' ' 49' ' ' MET . 71.2 mt -97.78 107.48 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 120.803 -1.185 . . . . 0.0 109.46 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 43.5 p -78.48 -28.12 46.39 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.8 m -88.67 29.58 0.99 Allowed 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.675 -0.64 . . . . 0.0 109.358 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.67 -66.64 0.46 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.508 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -50.8 -53.5 31.45 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.457 -0.777 . . . . 0.0 109.501 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.471 ' CD2' ' C7 ' ' C' ' 421' ' ' ' DT' . 13.8 tp -57.36 -45.43 84.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 109.049 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.604 HG21 ' SD ' ' A' ' 49' ' ' MET . 49.6 m -60.2 -40.34 89.71 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.155 -0.966 . . . . 0.0 108.744 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.425 HD22 HD13 ' A' ' 59' ' ' LEU . 10.9 mt -70.8 -47.16 60.94 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.493 -0.754 . . . . 0.0 110.009 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.507 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 39.8 ttm180 -62.89 -51.87 65.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.003 -1.061 . . . . 0.0 111.3 -178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 18.1 m -56.7 -54.84 41.53 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.05 -1.031 . . . . 0.0 110.531 -178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.56 -41.87 99.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.359 -0.838 . . . . 0.0 111.264 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.867 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.5 t80 -57.88 -40.53 80.48 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.576 -1.328 . . . . 0.0 109.521 -179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.548 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.3 ttm -52.82 -55.32 23.88 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.415 -0.803 . . . . 0.0 110.999 -178.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -73.36 -53.37 10.93 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.874 -1.141 . . . . 0.0 112.882 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -84.6 -46.99 10.99 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -174.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.631 HD12 ' N ' ' A' ' 106' ' ' LEU . 8.3 mp -97.45 -8.7 28.74 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.148 -1.595 . . . . 0.0 114.23 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.655 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 14.3 t80 -60.49 -38.37 56.65 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 119.725 -1.859 . . . . 0.0 109.099 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 52.5 Cg_exo -58.7 -59.74 0.44 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.578 2.186 . . . . 0.0 112.81 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -59.17 -40.86 86.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.614 -0.679 . . . . 0.0 109.518 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -69.99 -46.03 66.05 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.457 -0.777 . . . . 0.0 110.4 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ASN . 17.0 t -76.99 -45.62 26.72 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.234 -0.916 . . . . 0.0 109.912 -179.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -66.3 -49.81 65.78 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.245 -0.909 . . . . 0.0 111.266 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 28.9 mmtm -74.2 -29.34 61.7 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.971 -1.081 . . . . 0.0 111.545 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.576 ' HG2' HD21 ' A' ' 116' ' ' LEU . 19.6 tptp -125.04 -28.11 3.48 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.897 -1.127 . . . . 0.0 111.703 -177.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 111' ' ' CYS . 55.1 t30 56.28 47.5 19.08 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.666 -1.271 . . . . 0.0 110.619 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 114' ' ' LYS . 61.8 mt -69.02 -30.06 68.37 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.178 -0.951 . . . . 0.0 110.846 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 8.1 t -154.16 -165.94 2.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.017 -1.052 . . . . 0.0 111.092 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 70.6 p -130.48 155.49 81.01 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.562 -0.711 . . . . 0.0 109.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -51.54 -40.09 64.08 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.862 1.708 . . . . 0.0 112.526 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.99 89.24 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.836 -1.165 . . . . 0.0 109.384 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -66.36 -42.71 87.66 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 178.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.548 HD21 ' HG3' ' A' ' 103' ' ' MET . 16.3 tp -68.75 -51.45 41.11 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.557 -0.714 . . . . 0.0 110.212 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -58.94 -45.08 91.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.936 -1.103 . . . . 0.0 109.365 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.66 -42.46 98.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.131 -0.981 . . . . 0.0 110.327 -179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.91 -32.21 72.53 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 122.094 0.95 . . . . 0.0 108.728 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.437 ' CD1' ' HE2' ' A' ' 103' ' ' MET . 4.9 mt -64.53 -51.4 68.27 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.971 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -63.72 -38.77 92.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.455 -0.778 . . . . 0.0 109.381 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -59.9 -34.02 81.13 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.676 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -93.46 -35.49 12.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.138 -1.213 . . . . 0.0 110.117 -179.329 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.676 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 55.9 mtp180 -68.11 152.19 45.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.933 -1.104 . . . . 0.0 109.735 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.2 mmm180 -60.11 171.12 1.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.305 -0.872 . . . . 0.0 109.635 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -132.55 -152.76 0.51 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.56 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.997 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.004 0 O4'-C1'-C2' 108.291 1.991 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.108 0 O4'-C4'-C3' 107.9 2.3 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.859 0 O4'-C4'-C3' 107.496 1.896 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . 0.431 " H2'" ' H71' ' B' ' 405' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.354 0 O5'-C5'-C4' 113.274 2.196 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . 0.431 ' H71' " H2'" ' B' ' 404' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.263 0 O5'-C5'-C4' 113.204 2.146 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.995 0 O5'-C5'-C4' 113.148 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.959 0 O5'-C5'-C4' 112.926 1.947 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.597 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.433 -1.174 0 C4'-C3'-C2' 105.307 2.107 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O5'-C5'-C4' 113.313 2.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.397 0 O4'-C4'-C3' 107.818 2.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.059 0 O5'-C5'-C4' 113.348 2.249 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.932 0 O4'-C4'-C3' 108.042 2.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.803 0 O4'-C4'-C3' 107.875 2.275 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.681 0 O5'-C5'-C4' 112.667 1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.85 0 O4'-C4'-C3' 108.019 2.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.457 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.423 -2.065 0 O4'-C1'-C2' 107.956 1.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.457 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.605 0 O5'-C5'-C4' 113.625 2.446 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.45 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.774 0 O4'-C4'-C3' 107.348 1.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.45 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.593 0 O5'-C5'-C4' 113.761 2.543 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.445 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.525 1.693 0 O4'-C4'-C3' 107.851 2.251 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.531 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 P--O5' 1.611 1.768 0 O4'-C4'-C3' 107.53 1.93 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.531 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O5'-C5'-C4' 113.548 2.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O5'-C5'-C4' 113.48 2.343 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.02 0 O4'-C1'-C2' 108.728 2.389 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.949 0 O4'-C4'-C3' 108.162 2.562 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.972 0 O4'-C4'-C3' 107.68 2.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.536 0 O4'-C4'-C3' 107.854 2.254 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.668 0 O4'-C4'-C3' 107.593 1.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.135 0 O4'-C4'-C3' 107.955 2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.41 -3.247 0 C1'-O4'-C4' 106.487 -2.295 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.436 ' N ' ' NH2' ' A' ' 45' ' ' ARG . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.499 ' NE1' ' OE1' ' A' ' 9' ' ' GLN . 66.8 t90 -119.85 80.93 1.65 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.381 -1.07 . . . . 0.0 109.315 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.418 ' OG ' ' CG ' ' A' ' 8' ' ' GLU . 76.1 p -108.35 145.62 34.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.372 -0.83 . . . . 0.0 109.881 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -57.73 -44.69 86.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.638 -0.664 . . . . 0.0 111.247 -178.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.48 -42.72 98.56 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.735 -1.228 . . . . 0.0 110.014 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.418 ' CG ' ' OG ' ' A' ' 5' ' ' SER . 96.4 mt-10 -57.68 -44.75 86.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.139 -0.976 . . . . 0.0 110.062 -179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.621 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.3 mt-30 -66.71 -37.94 85.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.97 -1.081 . . . . 0.0 109.434 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -49.73 -50.52 43.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -62.58 -37.2 85.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.108 -0.995 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -65.43 -52.64 51.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.979 -1.075 . . . . 0.0 111.969 -178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -68.87 -33.85 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 120.824 -1.173 . . . . 0.0 110.567 -179.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -67.32 -36.4 81.4 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.053 -1.655 . . . . 0.0 108.702 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.442 ' NE2' ' HA ' ' A' ' 15' ' ' GLN . 12.3 mm-40 -59.16 -28.98 67.1 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.552 HD11 HD22 ' A' ' 46' ' ' LEU . 10.4 mt -67.66 -42.32 82.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.398 -0.814 . . . . 0.0 111.634 -179.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.8 m-85 -76.32 -33.75 59.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.37 -1.456 . . . . 0.0 109.634 -179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.496 ' O ' ' C ' ' A' ' 19' ' ' ILE . 75.7 mm-40 -62.62 -31.56 72.43 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.025 -1.047 . . . . 0.0 110.243 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.601 HD13 ' NH2' ' A' ' 25' ' ' ARG . 32.2 mt -36.98 -40.69 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.737 -0.602 . . . . 0.0 110.312 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.24 161.37 5.35 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.857 -1.152 . . . . 0.0 110.256 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -92.13 73.78 5.47 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -110.93 137.51 20.88 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -71.78 -62.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.251 1.967 . . . . 0.0 112.643 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -58.0 -33.64 69.15 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.056 -1.027 . . . . 0.0 109.276 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.601 ' NH2' HD13 ' A' ' 19' ' ' ILE . 58.0 ttt180 -61.87 -41.08 97.44 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.862 -1.149 . . . . 0.0 109.994 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -59.8 -59.57 5.22 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.016 -1.052 . . . . 0.0 109.883 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 7.8 pt-20 -53.15 -29.85 33.72 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.551 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -64.55 -61.98 1.87 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.005 -1.06 . . . . 0.0 109.996 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 16' ' ' LEU . 55.1 mt -53.63 -45.88 70.28 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.349 -0.844 . . . . 0.0 109.557 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.599 ' OD1' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -65.56 -49.52 68.57 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.519 -179.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.599 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 57.2 t0 -64.87 -39.85 94.19 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.189 -0.945 . . . . 0.0 109.001 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 59.7 tp -60.76 -49.7 76.44 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.155 -1.018 . . . . 0.0 109.058 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.618 ' CE1' HD12 ' A' ' 43' ' ' ILE . 47.7 m-85 -61.55 -35.3 77.38 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.6 t -68.08 -54.49 17.82 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.523 -0.735 . . . . 0.0 109.576 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.91 -40.85 85.76 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.227 -0.92 . . . . 0.0 109.722 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.418 ' CE ' ' O ' ' A' ' 41' ' ' THR . 75.2 mmm -60.36 -38.15 82.94 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.577 -0.702 . . . . 0.0 110.013 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -61.85 -39.19 90.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.125 -0.985 . . . . 0.0 109.375 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -64.43 -50.53 67.2 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.224 -0.923 . . . . 0.0 111.292 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.463 ' HE ' ' HB2' ' A' ' 108' ' ' PRO . 0.9 OUTLIER -63.69 -18.84 64.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.931 -1.106 . . . . 0.0 111.421 -177.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 4.18 61.36 Favored Glycine 0 N--CA 1.482 1.736 0 N-CA-C 107.746 -2.142 . . . . 0.0 107.746 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.418 ' O ' ' CE ' ' A' ' 36' ' ' MET . 19.4 p -114.62 83.38 8.85 Favored Pre-proline 0 N--CA 1.491 1.598 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.37 151.38 13.56 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 122.729 2.286 . . . . 0.0 111.235 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.618 HD12 ' CE1' ' A' ' 33' ' ' PHE . 18.3 mt -89.11 103.46 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 110.724 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 4.0 m120 -63.54 -74.51 0.1 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' NH2' ' N ' ' A' ' 3' ' ' GLY . 7.2 mtt180 -116.56 135.26 53.96 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.552 HD22 HD11 ' A' ' 16' ' ' LEU . 5.6 mt -69.15 144.43 95.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 C-N-CA 119.023 -1.071 . . . . 0.0 109.224 -179.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -65.82 134.88 39.2 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 121.2 1.267 . . . . 0.0 108.974 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.532 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 6.1 mt -102.37 145.74 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.024 -1.048 . . . . 0.0 110.242 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 75.6 mtp -142.73 119.3 11.04 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 49' ' ' MET . . . 71.8 39.13 0.88 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.4 mttm 59.77 24.27 13.21 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.242 0.544 . . . . 0.0 109.79 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.8 159.42 42.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.376 -0.827 . . . . 0.0 109.267 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 148.19 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.001 -1.062 . . . . 0.0 109.738 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.597 HD13 ' SD ' ' A' ' 49' ' ' MET . 63.6 tp -76.17 121.23 22.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.508 -0.745 . . . . 0.0 109.668 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.417 ' CG ' HH22 ' A' ' 25' ' ' ARG . 13.8 m-20 -65.04 93.43 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.378 -0.826 . . . . 0.0 109.162 -179.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.9 mt -56.15 -25.22 45.52 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.287 -0.883 . . . . 0.0 109.341 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -81.32 -58.74 2.91 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.2 -0.938 . . . . 0.0 111.759 -179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -57.37 -36.81 71.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.417 -1.427 . . . . 0.0 109.257 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.551 HD22 HD21 ' A' ' 54' ' ' LEU . 53.0 tp -61.63 -47.48 85.22 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.452 ' O ' ' C ' ' A' ' 61' ' ' ASN . 56.2 t80 -58.81 -70.09 0.16 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 60' ' ' TYR . 63.2 t30 -40.48 -39.31 0.99 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.443 -0.786 . . . . 0.0 109.708 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.521 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 6.1 mt -67.6 -50.73 56.83 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 178.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.815 HG21 ' CE2' ' A' ' 102' ' ' TYR . 40.6 t -57.01 -42.41 79.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 O-C-N 121.696 -0.628 . . . . 0.0 110.256 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.494 HG23 HD11 ' A' ' 116' ' ' LEU . 5.2 mm -70.15 -29.03 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 62' ' ' LEU . . . -56.21 -29.49 61.03 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.547 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.687 HH21 ' CB ' ' A' ' 80' ' ' GLU . 13.1 mmt180 -91.61 -4.41 55.31 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.612 -1.305 . . . . 0.0 108.78 179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.66 19.63 59.61 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.332 177.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 142.42 130.31 2.47 Favored Glycine 0 N--CA 1.498 2.811 0 O-C-N 120.28 -1.718 . . . . 0.0 111.475 178.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.569 HD11 ' HH2' ' A' ' 78' ' ' TRP . 10.7 tp -50.44 -39.76 48.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.584 -0.951 . . . . 0.0 110.464 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 ' HA ' ' A' ' 122' ' ' LEU . 60.1 t -57.02 -43.36 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.006 -1.059 . . . . 0.0 109.691 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -57.68 -39.38 77.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.863 -1.148 . . . . 0.0 109.448 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.618 ' O ' ' N ' ' A' ' 76' ' ' LYS . 46.6 t -62.38 -42.24 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.365 -0.834 . . . . 0.0 109.516 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.8 mt -66.41 -55.66 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 120.851 -1.156 . . . . 0.0 110.692 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -57.17 -42.0 80.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.02 -1.05 . . . . 0.0 110.351 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -94.58 -8.74 37.28 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.254 -0.904 . . . . 0.0 110.596 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.618 ' N ' ' O ' ' A' ' 72' ' ' VAL . 45.9 mttp 57.3 59.11 3.5 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.291 -0.881 . . . . 0.0 109.513 -177.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -88.29 12.89 12.8 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.011 -1.076 . . . . 0.0 108.77 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.569 ' HH2' HD11 ' A' ' 69' ' ' LEU . 71.3 m95 -63.24 -41.04 99.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.16 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' TRP . 15.5 mm100 -49.37 -38.7 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 120.292 -1.505 . . . . 0.0 108.53 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.687 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.7 mm-40 -71.32 -45.87 61.98 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 108.896 178.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.448 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.8 mt -64.69 -51.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.625 HD11 ' HB2' ' A' ' 95' ' ' ALA . 77.9 mt -52.35 -54.75 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -66.64 -40.93 88.92 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.138 -0.976 . . . . 0.0 109.555 179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -52.44 -32.29 37.66 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.4 mt -89.84 -7.88 53.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.402 -1.058 . . . . 0.0 108.801 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 64.66 42.06 4.94 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.604 -0.685 . . . . 0.0 110.618 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 16.5 mt -74.42 142.54 78.23 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.081 -1.012 . . . . 0.0 109.224 178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.581 ' C ' ' H ' ' A' ' 90' ' ' SER . 51.7 Cg_endo -72.13 142.16 37.52 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.158 1.906 . . . . 0.0 112.163 179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.1 t -56.49 0.99 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 109.761 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.581 ' H ' ' C ' ' A' ' 88' ' ' PRO . 19.4 m -65.8 -31.35 72.28 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.107 -0.995 . . . . 0.0 109.838 -178.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.625 HD11 ' H ' ' A' ' 50' ' ' ALA . 83.2 mt -93.93 98.26 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 120.822 -1.174 . . . . 0.0 109.486 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.9 p -69.84 -27.94 65.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 108.735 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.9 m -91.23 32.67 1.02 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.519 -0.738 . . . . 0.0 109.164 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.37 -65.52 0.68 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.09 -1.006 . . . . 0.0 108.727 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.625 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.77 -52.05 34.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 109.216 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.49 ' CD2' ' H73' ' C' ' 421' ' ' ' DT' . 5.8 tp -58.53 -43.51 89.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.861 -1.149 . . . . 0.0 109.055 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 21.6 m -60.56 -39.9 89.68 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.058 -1.026 . . . . 0.0 108.642 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.458 HD22 HD13 ' A' ' 59' ' ' LEU . 10.4 mt -70.2 -46.72 63.99 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.594 -0.691 . . . . 0.0 110.304 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.497 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 36.9 ttm180 -66.63 -50.92 61.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.066 . . . . 0.0 111.004 -179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 20.1 m -55.88 -50.99 69.13 Favored 'General case' 0 C--N 1.296 -1.726 0 C-N-CA 118.967 -1.093 . . . . 0.0 109.026 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -64.31 -43.67 93.99 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.093 -1.005 . . . . 0.0 111.503 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 63' ' ' VAL . 3.3 t80 -58.75 -41.01 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 120.274 -1.516 . . . . 0.0 108.859 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.908 ' SD ' HD21 ' A' ' 122' ' ' LEU . 42.9 mmm -51.97 -59.49 4.28 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.677 -0.639 . . . . 0.0 111.357 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -50.38 21.37 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.543 -1.348 . . . . 0.0 113.196 -177.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 106' ' ' LEU . 57.6 m-85 -82.0 -47.0 13.19 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 -174.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.65 HD12 ' N ' ' A' ' 106' ' ' LEU . 9.3 mp -104.28 6.19 35.2 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.394 -1.441 . . . . 0.0 114.044 -176.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.507 ' OH ' ' N ' ' A' ' 119' ' ' PRO . 48.1 t80 -65.05 -40.29 44.56 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 119.892 -1.755 . . . . 0.0 111.475 -179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.493 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 83.5 Cg_endo -77.79 -40.98 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 121.687 1.591 . . . . 0.0 113.317 -179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.59 -43.52 89.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.884 -1.135 . . . . 0.0 108.109 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -68.27 -54.61 16.36 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.517 -0.739 . . . . 0.0 109.932 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' A' ' 115' ' ' ASN . 91.8 m -70.62 -43.15 69.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.866 -178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.475 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 40.0 tp10 -67.09 -49.5 64.82 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.715 -1.24 . . . . 0.0 110.83 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -76.18 -27.28 56.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.044 -1.035 . . . . 0.0 111.036 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HG2' HD21 ' A' ' 116' ' ' LEU . 43.6 tptt -125.12 -27.3 3.55 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.974 -1.079 . . . . 0.0 111.954 -177.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.568 ' N ' ' O ' ' A' ' 111' ' ' CYS . 22.4 t30 58.72 45.23 16.05 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.523 -1.361 . . . . 0.0 110.376 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.494 HD11 HG23 ' A' ' 64' ' ' ILE . 87.4 mt -67.82 -32.0 72.25 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.037 -1.04 . . . . 0.0 110.871 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.47 ' OG ' ' OE1' ' A' ' 121' ' ' GLU . 26.0 t -153.23 -167.71 2.8 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 119.009 -1.076 . . . . 0.0 111.292 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 81.2 p -124.5 161.61 47.14 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.605 -0.684 . . . . 0.0 110.137 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.507 ' N ' ' OH ' ' A' ' 107' ' ' TYR . 23.3 Cg_exo -59.83 -40.97 58.53 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.602 1.535 . . . . 0.0 112.36 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.77 -37.11 86.15 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.143 -0.973 . . . . 0.0 109.871 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.47 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.5 mt-10 -67.69 -46.19 73.01 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.908 HD21 ' SD ' ' A' ' 103' ' ' MET . 11.4 tp -66.47 -52.08 49.96 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.485 -0.759 . . . . 0.0 109.879 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.25 -45.84 87.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.129 -0.982 . . . . 0.0 109.629 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.54 -39.41 87.78 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.25 -0.906 . . . . 0.0 109.873 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.33 -33.33 74.11 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.231 -0.918 . . . . 0.0 108.907 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.595 HD11 ' SD ' ' A' ' 103' ' ' MET . 8.0 mt -65.44 -48.96 81.05 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -64.0 -38.72 92.1 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.446 -0.784 . . . . 0.0 109.138 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.5 -34.08 84.17 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -95.14 -35.19 11.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.122 -1.222 . . . . 0.0 110.598 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.685 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 53.7 mtp180 -68.88 156.54 38.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.75 -1.218 . . . . 0.0 109.69 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.504 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 10.4 mpt_? -58.98 150.32 24.86 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -106.22 125.97 51.64 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.399 -0.813 . . . . 0.0 109.216 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.869 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.44 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.427 -1.691 0 O4'-C1'-C2' 107.791 1.537 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.575 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O4'-C1'-C2' 108.66 2.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.958 0 O4'-C4'-C3' 107.38 1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.84 2.24 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.856 0 O5'-C5'-C4' 113.148 2.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . 0.407 ' C5 ' ' C4 ' ' B' ' 407' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.332 0 O5'-C5'-C4' 112.949 1.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . 0.407 ' C4 ' ' C5 ' ' B' ' 406' ' ' ' DA' . . . . . . . . 0 P--O5' 1.614 2.108 0 O5'-C5'-C4' 113.104 2.074 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.532 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.432 -1.31 0 O4'-C1'-C2' 108.564 2.24 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . 0.492 ' C2 ' ' C2 ' ' C' ' 423' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.294 0 O5'-C5'-C4' 113.052 2.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.406 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.344 0 O5'-C5'-C4' 113.441 2.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.406 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.754 0 O5'-C5'-C4' 113.176 2.125 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.798 0 O5'-C5'-C4' 113.804 2.574 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.7 0 O4'-C4'-C3' 107.971 2.371 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.744 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.855 0 O4'-C4'-C3' 108.03 2.43 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.835 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.911 0 O4'-C1'-C2' 109.041 2.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.176 0 O4'-C4'-C3' 108.018 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.405 ' C2 ' ' C2 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.986 0 O5'-C5'-C4' 112.808 1.863 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.405 ' C2 ' ' C2 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.761 0 O5'-C5'-C4' 113.9 2.643 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.508 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.758 2.158 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.599 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.24 0 O5'-C5'-C4' 113.473 2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.599 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.128 0 O5'-C5'-C4' 113.473 2.338 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . 0.492 ' C2 ' ' C2 ' ' B' ' 409' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.979 0 O5'-C5'-C4' 113.283 2.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.358 0 O4'-C1'-C2' 108.875 2.523 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.313 0 O5'-C5'-C4' 113.615 2.439 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.533 0 O4'-C4'-C3' 107.472 1.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.67 0 O4'-C4'-C3' 107.796 2.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.011 0 O4'-C4'-C3' 107.659 2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O4'-C4'-C3' 107.819 2.219 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.027 0 O4'-C4'-C3' 107.532 1.932 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.509 ' CE3' ' OD1' ' A' ' 44' ' ' ASN . 35.7 p90 -67.37 152.96 44.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.328 -1.101 . . . . 0.0 109.385 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.5 p -103.07 141.76 35.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.328 -0.858 . . . . 0.0 109.852 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -55.99 -34.72 66.04 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.665 -0.647 . . . . 0.0 111.205 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.25 -44.83 95.66 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.735 -1.228 . . . . 0.0 109.581 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -57.43 -43.36 83.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.112 -0.992 . . . . 0.0 109.523 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.761 ' O ' HG13 ' A' ' 13' ' ' VAL . 2.0 mp0 -72.25 -38.89 68.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.277 -0.889 . . . . 0.0 109.851 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.31 -50.9 68.39 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.121 -0.987 . . . . 0.0 109.811 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -62.03 -45.08 95.17 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.09 -1.006 . . . . 0.0 109.66 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -63.71 -47.84 79.52 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.378 -0.826 . . . . 0.0 110.278 -179.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.761 HG13 ' O ' ' A' ' 9' ' ' GLN . 2.3 m -72.78 -36.46 52.56 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 O-C-N 120.644 -1.285 . . . . 0.0 108.567 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.43 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -56.93 -40.16 75.85 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.492 -1.38 . . . . 0.0 107.761 178.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.441 ' HA ' HE21 ' A' ' 15' ' ' GLN . 0.1 OUTLIER -58.79 -30.47 67.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.431 -0.908 . . . . 0.0 108.607 178.247 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.459 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.1 mt -71.72 -39.18 70.31 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.415 -0.803 . . . . 0.0 111.661 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 29' ' ' LEU . 98.4 m-85 -76.47 -32.83 58.61 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.402 -1.436 . . . . 0.0 110.29 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.467 ' O ' ' C ' ' A' ' 19' ' ' ILE . 97.2 mt-10 -66.52 -25.85 66.88 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.899 -1.126 . . . . 0.0 110.386 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 HH21 ' A' ' 25' ' ' ARG . 30.3 mt -38.96 -39.72 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 O-C-N 121.605 -0.684 . . . . 0.0 110.397 -179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 1.2 m120 -171.33 161.84 6.6 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.739 -1.226 . . . . 0.0 110.315 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -90.5 65.16 6.02 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.47 0.653 . . . . 0.0 109.3 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -111.9 103.22 55.04 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.502 -0.749 . . . . 0.0 109.136 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -47.83 -43.47 29.2 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 C-N-CA 122.015 1.81 . . . . 0.0 111.957 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -61.62 -38.48 87.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.19 -0.944 . . . . 0.0 108.535 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.679 HH11 ' HG2' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -60.36 -44.53 95.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.5 -0.75 . . . . 0.0 109.389 179.89 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.3 -53.54 53.59 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.311 -0.868 . . . . 0.0 109.77 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -52.74 -39.05 61.78 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.432 -0.793 . . . . 0.0 109.175 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -61.12 -63.01 1.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.325 -0.859 . . . . 0.0 109.858 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.585 HD11 ' NH1' ' A' ' 25' ' ' ARG . 43.7 mt -56.2 -44.72 79.75 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.585 -0.697 . . . . 0.0 109.521 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -61.93 -46.53 88.94 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.704 -0.798 . . . . 0.0 109.121 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -66.59 -42.91 86.21 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.7 tp -61.07 -49.3 77.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.188 -0.945 . . . . 0.0 110.658 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -60.43 -36.44 78.19 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.284 -1.51 . . . . 0.0 107.528 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.3 t -69.93 -53.27 18.64 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.508 -0.745 . . . . 0.0 109.478 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.406 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 76.6 t80 -58.73 -42.38 88.62 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.609 -0.682 . . . . 0.0 111.17 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.446 ' CE ' ' O ' ' A' ' 41' ' ' THR . 63.4 mmm -56.49 -38.2 71.41 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.142 -0.974 . . . . 0.0 110.915 -178.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -55.68 -40.18 71.99 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.765 -1.209 . . . . 0.0 108.499 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 tppt? -64.91 -39.54 93.67 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.884 0.85 . . . . 0.0 108.739 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.406 ' HD3' ' CZ ' ' A' ' 35' ' ' PHE . 21.8 mmm180 -64.31 -30.52 71.57 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.522 -0.736 . . . . 0.0 109.265 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.26 -0.83 60.3 Favored Glycine 0 N--CA 1.485 1.948 0 N-CA-C 108.152 -1.979 . . . . 0.0 108.152 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.446 ' O ' ' CE ' ' A' ' 36' ' ' MET . 44.9 p -120.27 84.37 34.44 Favored Pre-proline 0 N--CA 1.488 1.445 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -82.76 141.93 11.1 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.439 2.093 . . . . 0.0 110.915 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 19.4 mt -78.8 101.23 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 120.928 -1.107 . . . . 0.0 110.159 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.509 ' OD1' ' CE3' ' A' ' 4' ' ' TRP . 3.1 m120 -82.91 -4.09 57.75 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.626 ' NE ' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -170.4 124.45 0.71 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.43 HD22 HD11 ' A' ' 16' ' ' LEU . 2.3 mt -73.09 147.56 88.3 Favored Pre-proline 0 C--N 1.291 -1.971 0 O-C-N 121.412 -0.805 . . . . 0.0 109.243 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -73.78 133.45 18.57 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.526 1.484 . . . . 0.0 108.999 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.603 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 42.2 mt -101.0 142.51 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.777 -1.202 . . . . 0.0 110.509 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.744 ' SD ' HD13 ' A' ' 54' ' ' LEU . 79.0 mtp -135.07 121.69 20.72 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.585 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 66.48 41.42 3.2 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -178.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 56.94 22.84 7.58 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.369 0.604 . . . . 0.0 109.681 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -132.79 148.44 52.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.399 -0.813 . . . . 0.0 109.14 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 10.2 m -67.0 145.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 120.895 -1.128 . . . . 0.0 108.955 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.744 HD13 ' SD ' ' A' ' 49' ' ' MET . 36.9 tp -77.11 122.57 25.17 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.307 -0.871 . . . . 0.0 109.795 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -65.84 90.96 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.525 -0.735 . . . . 0.0 109.565 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.3 -24.33 28.08 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 120.877 -1.139 . . . . 0.0 109.438 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.592 ' CZ ' ' OD1' ' A' ' 61' ' ' ASN . 43.6 t80 -77.98 -59.35 2.82 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.227 -0.92 . . . . 0.0 111.654 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -60.22 -38.36 83.15 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.834 -1.166 . . . . 0.0 110.615 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.499 HD13 HD22 ' A' ' 98' ' ' LEU . 32.1 tp -58.5 -45.03 89.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.64 -1.245 . . . . 0.0 107.64 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.545 ' CZ ' HD11 ' A' ' 64' ' ' ILE . 43.7 t80 -57.04 -68.43 0.23 Allowed 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.662 ' N ' HD22 ' A' ' 61' ' ' ASN . 1.2 m120 -39.91 -42.21 1.3 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.613 -0.679 . . . . 0.0 111.142 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.609 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 5.7 mt -69.47 -44.31 71.44 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.116 -1.433 . . . . 0.0 107.314 179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.811 HG21 ' CE2' ' A' ' 102' ' ' TYR . 34.8 t -58.43 -44.04 87.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 121.261 -0.9 . . . . 0.0 110.288 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.545 HD11 ' CZ ' ' A' ' 60' ' ' TYR . 1.2 mm -69.42 -34.11 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.386 -1.446 . . . . 0.0 107.986 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.38 -24.11 28.02 Favored 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 120.096 -0.641 . . . . 0.0 109.562 -178.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.632 HH21 ' CB ' ' A' ' 80' ' ' GLU . 7.5 mmt-85 -92.95 -4.39 52.81 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.678 -1.264 . . . . 0.0 108.898 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 19.05 62.63 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.058 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 143.23 128.17 2.19 Favored Glycine 0 N--CA 1.5 2.942 0 O-C-N 120.342 -1.681 . . . . 0.0 111.815 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 102' ' ' TYR . 8.1 tp -48.93 -39.34 25.87 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.601 -0.941 . . . . 0.0 109.723 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' A' ' 122' ' ' LEU . 92.8 t -58.82 -43.11 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 109.805 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -56.01 -40.78 73.9 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.0 109.208 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.607 ' O ' ' N ' ' A' ' 76' ' ' LYS . 48.0 t -60.97 -43.95 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.392 -0.818 . . . . 0.0 109.216 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 122' ' ' LEU . 88.4 mt -66.57 -56.36 14.53 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 O-C-N 121.043 -1.036 . . . . 0.0 110.572 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.75 -42.83 79.98 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.991 -1.068 . . . . 0.0 110.322 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -93.28 -8.97 40.63 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.089 -1.007 . . . . 0.0 110.223 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.607 ' N ' ' O ' ' A' ' 72' ' ' VAL . 24.3 mtmm 57.93 60.71 2.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.299 -0.876 . . . . 0.0 109.387 -178.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.0 mt -91.2 14.76 13.39 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.466 ' CE2' HG12 ' A' ' 72' ' ' VAL . 83.0 m95 -63.73 -39.79 95.17 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.389 -0.82 . . . . 0.0 109.132 179.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.409 ' NE2' " H3'" ' C' ' 418' ' ' ' DA' . 77.6 mm-40 -50.49 -39.09 47.45 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.456 -1.403 . . . . 0.0 108.252 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.632 ' CB ' HH21 ' A' ' 66' ' ' ARG . 97.6 mt-10 -69.62 -43.14 73.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.45 -51.96 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 ' HB2' ' A' ' 95' ' ' ALA . 85.6 mt -52.36 -51.59 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -0.884 . . . . 0.0 108.866 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.11 -41.63 85.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.198 -0.939 . . . . 0.0 109.688 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.05 -31.53 40.55 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.3 mt -89.38 -8.83 52.31 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.477 -1.014 . . . . 0.0 109.004 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 59.0 m-70 61.49 40.4 13.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.2 mt -73.46 141.15 79.7 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.54 ' C ' ' H ' ' A' ' 90' ' ' SER . 30.8 Cg_endo -67.48 138.37 45.81 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 121.884 1.723 . . . . 0.0 112.155 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.7 t -56.1 -0.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.297 -0.877 . . . . 0.0 110.035 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 88' ' ' PRO . 16.0 m -64.87 -30.82 71.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 109.718 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.585 HD11 ' H ' ' A' ' 50' ' ' ALA . 68.7 mt -93.22 101.32 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.923 -1.111 . . . . 0.0 109.406 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 44.5 p -72.79 -28.02 62.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.076 -1.015 . . . . 0.0 108.662 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.4 m -89.56 30.05 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.409 ' N ' HG22 ' A' ' 91' ' ' ILE . . . -60.06 -65.35 0.69 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.761 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -49.59 -52.62 29.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.451 -0.78 . . . . 0.0 109.607 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.51 HD22 ' C7 ' ' C' ' 421' ' ' ' DT' . 6.0 tp -58.79 -43.99 90.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.872 -1.142 . . . . 0.0 109.304 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.7 m -60.17 -38.63 83.79 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.097 -1.002 . . . . 0.0 108.597 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.499 HD22 HD13 ' A' ' 59' ' ' LEU . 9.8 mt -70.8 -46.5 62.72 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.614 -0.678 . . . . 0.0 109.85 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.531 ' NH1' ' OD1' ' A' ' 129' ' ' ASN . 38.0 ttm180 -65.87 -51.35 59.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 111.179 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.5 m -55.94 -53.39 57.39 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.287 -0.883 . . . . 0.0 110.108 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -63.09 -41.14 99.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.171 -0.956 . . . . 0.0 111.273 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.811 ' CE2' HG21 ' A' ' 63' ' ' VAL . 2.8 t80 -57.03 -41.44 78.62 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.112 -1.617 . . . . 0.0 109.447 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.608 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -55.94 -55.54 31.4 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.387 -0.82 . . . . 0.0 112.157 -178.612 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 mttm -70.94 -53.27 15.56 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 120.84 -1.163 . . . . 0.0 112.702 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.483 ' C ' HD12 ' A' ' 106' ' ' LEU . 55.7 m-85 -84.31 -44.6 13.67 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -175.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.1 mp -102.96 6.4 38.89 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.36 -1.463 . . . . 0.0 113.913 -176.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.576 ' CE1' ' SG ' ' A' ' 111' ' ' CYS . 49.0 t80 -62.42 -42.79 82.14 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 119.855 -1.778 . . . . 0.0 111.625 -179.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 112' ' ' GLU . 95.4 Cg_endo -76.96 -41.87 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 121.473 1.448 . . . . 0.0 112.823 -178.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -57.32 -38.97 74.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.82 -1.175 . . . . 0.0 107.981 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.491 ' O ' ' OE1' ' A' ' 110' ' ' GLU . 4.7 tp10 -73.5 -54.8 7.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.608 -0.682 . . . . 0.0 110.282 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.577 ' O ' ' N ' ' A' ' 115' ' ' ASN . 98.1 m -73.02 -41.42 64.26 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.318 -0.864 . . . . 0.0 111.16 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' A' ' 108' ' ' PRO . 46.9 tp10 -66.64 -44.8 80.99 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.706 -1.246 . . . . 0.0 110.587 -178.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -74.66 -33.63 62.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.195 -0.941 . . . . 0.0 111.253 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.505 ' HG2' HD21 ' A' ' 116' ' ' LEU . 4.1 tppt? -125.18 -24.37 4.01 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.938 -1.101 . . . . 0.0 111.773 -177.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 111' ' ' CYS . 17.3 t-20 57.01 44.94 21.97 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.631 -1.293 . . . . 0.0 110.23 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.505 HD21 ' HG2' ' A' ' 114' ' ' LYS . 79.6 mt -67.5 -29.62 69.09 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.089 -1.007 . . . . 0.0 110.828 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 118' ' ' THR . 46.5 t -152.66 -169.0 3.21 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.855 -1.138 . . . . 0.0 111.355 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.431 ' N ' ' OG ' ' A' ' 117' ' ' SER . 73.4 p -128.84 166.79 22.44 Favored Pre-proline 0 N--CA 1.498 1.974 0 O-C-N 121.593 -0.692 . . . . 0.0 109.61 -178.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -62.88 -40.4 35.54 Favored 'Trans proline' 0 N--CA 1.492 1.41 0 C-N-CA 121.382 1.388 . . . . 0.0 111.908 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.53 87.59 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.064 -1.023 . . . . 0.0 109.306 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -66.46 -45.63 79.08 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 178.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.608 HD21 ' HG3' ' A' ' 103' ' ' MET . 29.3 tp -66.17 -51.03 61.73 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.352 -0.842 . . . . 0.0 109.972 179.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -57.26 -46.99 82.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.081 -1.012 . . . . 0.0 109.647 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.498 ' O ' ' OD1' ' A' ' 127' ' ' ASP . . . -61.1 -41.02 95.91 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.299 -0.876 . . . . 0.0 110.082 -179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -68.63 -34.36 75.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 108.417 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.496 ' CD1' ' CE ' ' A' ' 103' ' ' MET . 10.5 mt -63.94 -49.99 79.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.677 ' OD1' ' N ' ' A' ' 128' ' ' GLY . 18.9 p30 -65.75 -32.58 74.21 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 118.863 -1.135 . . . . 0.0 108.588 179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.677 ' N ' ' OD1' ' A' ' 127' ' ' ASP . . . -65.61 -30.23 76.92 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.645 ' ND2' ' N ' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -90.69 -35.99 14.6 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.004 -1.291 . . . . 0.0 110.741 -179.082 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' N ' ' ND2' ' A' ' 129' ' ' ASN . 72.6 mtm180 -62.2 145.81 52.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.783 -1.198 . . . . 0.0 109.266 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.4 mpt_? -67.51 142.01 56.72 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.352 -0.843 . . . . 0.0 109.736 -179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -65.21 -22.44 66.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.446 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.963 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.43 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.425 -1.917 0 O4'-C1'-C2' 108.004 1.731 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.445 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.085 0 O4'-C1'-C2' 108.506 2.187 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.937 0 O4'-C4'-C3' 107.429 1.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.438 0 O5'-C5'-C4' 113.377 2.269 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.991 0 O5'-C5'-C4' 113.134 2.095 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O5'-C5'-C4' 113.135 2.096 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . 0.558 ' P ' HH11 ' A' ' 45' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.693 0 O5'-C5'-C4' 112.87 1.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.603 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 O4'--C4' 1.431 -1.331 0 O4'-C4'-C3' 107.927 2.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.147 0 O5'-C5'-C4' 113.179 2.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.418 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 P--O5' 1.614 2.079 0 O4'-C1'-C2' 108.622 2.293 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.418 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.004 0 O5'-C5'-C4' 112.979 1.985 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.898 0 O4'-C4'-C3' 107.833 2.233 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.883 0 O4'-C4'-C3' 107.825 2.225 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.789 0 O4'-C4'-C3' 107.455 1.855 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.096 0 O4'-C4'-C3' 107.981 2.381 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.45 " H2'" ' C5 ' ' C' ' 417' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.421 -2.267 0 O4'-C1'-C2' 107.676 1.433 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . 0.45 ' C5 ' " H2'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C4'-C3' 108.097 2.497 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.409 " H3'" ' NE2' ' A' ' 79' ' ' GLN . . . . . . . . 0 C5'--C4' 1.527 1.994 0 O4'-C4'-C3' 107.318 1.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.345 0 O5'-C5'-C4' 113.529 2.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.546 ' OP1' ' ND2' ' A' ' 129' ' ' ASN . . . . . . . . 0 O4'--C4' 1.426 -1.831 0 O4'-C4'-C3' 107.839 2.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.51 ' C7 ' HD22 ' A' ' 96' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.163 0 O5'-C5'-C4' 113.145 2.104 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.208 0 O5'-C5'-C4' 113.497 2.355 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.046 0 O5'-C5'-C4' 113.287 2.205 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.615 2.162 0 O4'-C1'-C2' 108.67 2.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.168 0 O4'-C4'-C3' 108.088 2.488 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.316 0 O4'-C4'-C3' 107.657 2.057 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.365 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.952 0 O4'-C4'-C3' 107.746 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.933 0 O4'-C4'-C3' 107.746 2.146 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.972 0 O4'-C4'-C3' 107.531 1.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.582 ' NE1' ' OE1' ' A' ' 9' ' ' GLN . 44.1 p90 -149.96 167.54 26.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 108.919 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.24 135.99 42.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.038 -1.039 . . . . 0.0 110.063 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -54.94 -34.41 63.2 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.606 -0.684 . . . . 0.0 109.829 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.37 -44.21 95.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.873 -1.142 . . . . 0.0 108.971 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -57.14 -45.48 83.51 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.215 -0.928 . . . . 0.0 109.027 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.86 ' O ' HG12 ' A' ' 13' ' ' VAL . 38.9 mt-30 -70.52 -36.82 73.96 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.118 -0.989 . . . . 0.0 109.09 178.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -48.24 -47.27 35.93 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.476 -0.765 . . . . 0.0 109.606 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -62.14 -41.85 98.67 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.162 -0.961 . . . . 0.0 108.687 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 -66.78 -52.95 38.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.683 -0.635 . . . . 0.0 111.454 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.86 HG12 ' O ' ' A' ' 9' ' ' GLN . 0.9 OUTLIER -71.47 -37.46 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.989 -1.069 . . . . 0.0 109.959 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.405 ' HB2' ' HE ' ' A' ' 14' ' ' ARG . 6.1 tpp180 -60.19 -39.5 86.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.083 -1.636 . . . . 0.0 108.214 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.401 HE21 ' HA ' ' A' ' 15' ' ' GLN . 7.4 mm-40 -58.3 -30.71 66.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.598 HD13 HD22 ' A' ' 29' ' ' LEU . 10.9 mt -68.08 -39.46 82.92 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.457 -0.777 . . . . 0.0 111.529 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.487 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 90.8 m-85 -77.52 -37.67 50.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.357 -1.464 . . . . 0.0 110.289 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.488 ' O ' ' C ' ' A' ' 19' ' ' ILE . 96.8 mt-10 -64.1 -27.82 69.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.119 -0.988 . . . . 0.0 111.132 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.644 HD13 ' NH2' ' A' ' 25' ' ' ARG . 16.5 mt -36.1 -40.18 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.592 -0.693 . . . . 0.0 110.578 -178.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.59 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -172.69 167.74 5.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.836 -1.165 . . . . 0.0 110.356 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 21' ' ' ASP . 53.6 p30 -90.53 65.39 6.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.575 -0.703 . . . . 0.0 110.707 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -101.89 136.01 19.6 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.955 . . . . 0.0 108.46 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.503 ' O ' ' OE1' ' A' ' 27' ' ' GLU . 67.4 Cg_endo -75.72 -62.61 0.03 OUTLIER 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 122.049 1.833 . . . . 0.0 112.656 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -55.02 -36.82 65.89 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.416 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.644 ' NH2' HD13 ' A' ' 19' ' ' ILE . 57.9 ttt180 -57.31 -38.42 73.98 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.221 -0.924 . . . . 0.0 109.765 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -60.12 -58.48 8.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.158 -0.963 . . . . 0.0 109.763 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.503 ' OE1' ' O ' ' A' ' 23' ' ' PRO . 44.2 mp0 -53.4 -33.65 54.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.321 -0.862 . . . . 0.0 109.995 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -60.96 -63.19 1.38 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.155 -0.965 . . . . 0.0 110.896 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.598 HD22 HD13 ' A' ' 16' ' ' LEU . 28.1 mt -56.17 -45.44 79.72 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.037 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 38.4 m-20 -62.41 -46.21 89.62 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.599 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.95 -44.39 80.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.223 -0.923 . . . . 0.0 109.782 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 53.2 tp -56.51 -47.88 78.41 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 110.267 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.468 ' CD2' ' O ' ' A' ' 29' ' ' LEU . 45.3 m-85 -61.23 -34.74 75.6 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 118.311 -1.356 . . . . 0.0 108.385 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 m -69.25 -55.13 11.43 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.274 -0.891 . . . . 0.0 110.457 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 39' ' ' ARG . 43.0 t80 -60.36 -37.2 79.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.309 -0.869 . . . . 0.0 110.921 -179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.5 mmm -59.44 -37.61 78.57 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.17 -0.956 . . . . 0.0 110.867 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -62.93 -39.76 95.56 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.962 -1.086 . . . . 0.0 110.82 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -63.39 -36.99 85.53 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.655 ' CG ' HH11 ' A' ' 39' ' ' ARG . 0.0 OUTLIER -65.03 -29.04 69.91 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.386 -179.286 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.71 -1.76 63.97 Favored Glycine 0 C--N 1.295 -1.717 0 N-CA-C 107.44 -2.264 . . . . 0.0 107.44 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.4 p -116.93 84.02 15.45 Favored Pre-proline 0 N--CA 1.49 1.539 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -86.59 143.18 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.684 2.256 . . . . 0.0 110.575 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.549 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 20.3 mt -78.73 99.44 3.09 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 O-C-N 120.866 -1.146 . . . . 0.0 109.389 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.481 ' HB3' HH12 ' A' ' 45' ' ' ARG . 89.7 m-20 -67.59 -38.11 83.55 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 178.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.642 HH11 ' HB3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -144.28 130.56 19.72 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 178.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.503 HD23 HG21 ' A' ' 43' ' ' ILE . 7.3 mt -71.46 147.61 92.72 Favored Pre-proline 0 C--N 1.298 -1.647 0 O-C-N 121.287 -0.883 . . . . 0.0 109.504 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -71.41 138.69 33.25 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 121.685 1.59 . . . . 0.0 109.429 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.586 ' O ' ' P ' ' B' ' 408' ' ' ' DT' . 41.3 mt -104.41 143.14 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.044 -1.035 . . . . 0.0 110.379 -178.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.618 ' SD ' HG21 ' A' ' 97' ' ' THR . 76.7 mmm -135.35 127.3 29.56 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 59.58 42.47 17.29 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 75.2 mttt 59.72 25.62 14.62 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.415 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.501 ' N ' HG23 ' A' ' 48' ' ' ILE . 82.5 p -138.35 154.71 48.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.1 -1.0 . . . . 0.0 109.794 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 8.7 m -67.16 144.24 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 120.939 -1.101 . . . . 0.0 109.263 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.509 HD21 HD22 ' A' ' 59' ' ' LEU . 60.1 tp -77.59 123.95 27.29 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.533 -0.73 . . . . 0.0 109.848 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.55 ' CG ' HH22 ' A' ' 25' ' ' ARG . 6.8 m-20 -66.28 90.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.339 -0.851 . . . . 0.0 109.437 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.95 -23.03 11.68 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 121.053 -1.029 . . . . 0.0 109.174 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.58 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 46.5 t80 -78.91 -58.95 2.98 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.228 -0.92 . . . . 0.0 111.618 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -58.61 -36.46 74.05 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.661 -1.275 . . . . 0.0 109.898 -178.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 54' ' ' LEU . 62.0 tp -62.77 -43.0 99.94 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.444 ' CE2' HG13 ' A' ' 64' ' ' ILE . 60.7 t80 -61.16 -69.94 0.21 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.815 -0.553 . . . . 0.0 109.56 179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.818 ' H ' HD22 ' A' ' 61' ' ' ASN . 1.2 m-80 -42.73 -37.24 1.69 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.323 -0.86 . . . . 0.0 109.732 -179.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.506 HD13 ' HA ' ' A' ' 81' ' ' ILE . 9.5 mt -67.33 -51.8 48.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.856 HG21 ' CE2' ' A' ' 102' ' ' TYR . 38.8 t -57.92 -43.99 85.72 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.702 -0.624 . . . . 0.0 109.605 179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.506 HD12 ' OE1' ' A' ' 110' ' ' GLU . 14.2 mm -69.06 -37.88 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 107.618 -1.252 . . . . 0.0 107.618 179.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -17.55 32.76 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 120.269 -0.573 . . . . 0.0 109.794 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.681 ' HG3' HD13 ' A' ' 77' ' ' LEU . 7.5 mpt_? -97.87 4.35 49.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.838 -1.164 . . . . 0.0 109.361 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.61 12.32 80.36 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.107 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 133.2 138.33 4.03 Favored Glycine 0 N--CA 1.504 3.202 0 O-C-N 120.512 -1.581 . . . . 0.0 111.701 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 102' ' ' TYR . 7.5 tp -50.75 -43.07 58.13 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.766 -0.844 . . . . 0.0 111.349 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 122' ' ' LEU . 94.8 t -60.03 -42.16 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 120.73 -1.231 . . . . 0.0 110.062 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -55.43 -37.98 68.38 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.012 -1.055 . . . . 0.0 109.313 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.598 ' O ' ' N ' ' A' ' 76' ' ' LYS . 54.5 t -64.3 -43.62 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.584 -0.698 . . . . 0.0 109.936 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.5 mt -66.34 -58.2 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.854 -1.153 . . . . 0.0 110.987 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.409 ' OD1' ' HB1' ' A' ' 125' ' ' ALA . 88.7 m-20 -57.12 -41.48 79.08 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.034 -1.041 . . . . 0.0 110.344 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp -93.06 -10.57 35.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.179 -0.95 . . . . 0.0 110.608 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.598 ' N ' ' O ' ' A' ' 72' ' ' VAL . 48.8 mttp 59.18 60.6 2.33 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.38 -0.825 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.681 HD13 ' HG3' ' A' ' 66' ' ' ARG . 13.7 mt -91.43 13.39 17.69 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.911 -1.118 . . . . 0.0 108.107 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.476 ' CE2' HG12 ' A' ' 72' ' ' VAL . 85.1 m95 -63.05 -41.32 99.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.352 -0.842 . . . . 0.0 109.398 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 78' ' ' TRP . 99.3 mm-40 -50.62 -36.7 36.52 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 118.054 -1.458 . . . . 0.0 108.112 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' HB3' HH21 ' A' ' 66' ' ' ARG . 78.0 mm-40 -71.17 -43.34 67.66 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.506 ' HA ' HD13 ' A' ' 62' ' ' LEU . 5.0 mt -67.8 -54.16 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.541 HD11 ' HB2' ' A' ' 95' ' ' ALA . 59.3 mt -53.13 -54.58 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -67.79 -40.55 83.91 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.174 -0.954 . . . . 0.0 109.32 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -53.38 -32.22 44.5 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.6 mt -89.57 -7.73 54.22 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.469 -1.018 . . . . 0.0 108.631 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 65.12 40.8 4.85 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.308 0.575 . . . . 0.0 110.097 179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 30.1 mt -72.47 148.77 90.81 Favored Pre-proline 0 N--CA 1.489 1.477 0 O-C-N 121.219 -0.926 . . . . 0.0 108.955 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.49 164.61 33.62 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.328 2.019 . . . . 0.0 112.129 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.8 m -82.66 -0.03 45.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.364 -0.835 . . . . 0.0 108.855 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 15.6 m -65.49 -33.4 75.83 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.601 -0.687 . . . . 0.0 110.235 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.419 HD13 ' SD ' ' A' ' 49' ' ' MET . 89.3 mt -91.51 100.43 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.672 -1.267 . . . . 0.0 109.312 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 67.1 p -72.24 -23.32 61.2 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.272 -0.892 . . . . 0.0 109.139 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.0 m -101.55 40.67 1.28 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.492 -0.755 . . . . 0.0 109.156 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -63.08 1.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.343 -0.848 . . . . 0.0 108.853 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.541 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -46.36 -50.91 15.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 109.539 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.462 HD22 ' H73' ' C' ' 421' ' ' ' DT' . 5.6 tp -58.71 -42.47 88.75 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.788 -1.195 . . . . 0.0 109.171 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.618 HG21 ' SD ' ' A' ' 49' ' ' MET . 19.7 m -62.42 -41.17 98.5 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.127 -0.983 . . . . 0.0 108.819 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.455 HD22 HD13 ' A' ' 59' ' ' LEU . 8.5 mt -69.57 -48.35 60.58 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.722 -0.611 . . . . 0.0 109.816 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.711 ' NH1' ' ND2' ' A' ' 129' ' ' ASN . 38.0 ttm180 -63.35 -51.08 67.4 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.239 -0.913 . . . . 0.0 110.974 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 6.5 m -55.64 -55.12 35.8 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.236 -0.915 . . . . 0.0 109.792 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -63.3 -42.02 99.01 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -0.887 . . . . 0.0 111.477 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.856 ' CE2' HG21 ' A' ' 63' ' ' VAL . 5.2 t80 -57.83 -40.94 81.21 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.278 -1.514 . . . . 0.0 109.321 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.587 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.5 ttm -53.01 -56.85 12.98 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.555 -0.715 . . . . 0.0 111.566 -178.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mttm -74.58 -52.65 11.22 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.871 -1.143 . . . . 0.0 113.151 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -83.25 -47.76 11.19 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -174.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 106' ' ' LEU . 11.2 mp -97.11 -3.2 41.61 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.169 -1.582 . . . . 0.0 113.4 -176.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.658 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 74.8 t80 -64.14 -35.77 16.72 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 119.981 -1.699 . . . . 0.0 109.876 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.658 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 25.7 Cg_exo -63.6 -55.13 0.75 Allowed 'Trans proline' 0 N--CA 1.5 1.888 0 C-N-CA 122.427 2.085 . . . . 0.0 112.545 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.82 -46.14 85.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.42 -0.8 . . . . 0.0 109.212 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.506 ' OE1' HD12 ' A' ' 64' ' ' ILE . 3.4 tp10 -66.25 -53.57 35.33 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.317 -0.864 . . . . 0.0 109.727 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.6 t -67.24 -45.38 76.92 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 110.353 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 37.4 tp10 -67.26 -48.91 66.33 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.165 -0.96 . . . . 0.0 111.379 -178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -73.57 -32.45 64.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.107 -0.996 . . . . 0.0 112.246 -177.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HG2' HD21 ' A' ' 116' ' ' LEU . 2.2 tppt? -125.18 -27.54 3.51 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.888 -1.132 . . . . 0.0 111.854 -177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.59 45.47 24.77 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.742 -1.224 . . . . 0.0 110.528 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.538 HD21 ' HG2' ' A' ' 114' ' ' LYS . 72.9 mt -68.05 -28.39 67.34 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.029 -1.044 . . . . 0.0 110.943 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 118' ' ' THR . 30.6 t -152.49 -167.01 2.63 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 118.733 -1.187 . . . . 0.0 111.607 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.534 ' N ' ' OG ' ' A' ' 117' ' ' SER . 76.7 p -131.41 158.55 74.98 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.661 -0.649 . . . . 0.0 109.914 -178.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.11 -40.4 86.01 Favored 'Trans proline' 0 N--CA 1.492 1.409 0 C-N-CA 121.671 1.581 . . . . 0.0 112.437 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.77 -38.9 92.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.782 -1.199 . . . . 0.0 109.788 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.417 ' OE1' ' OG ' ' A' ' 117' ' ' SER . 99.6 mt-10 -65.09 -41.06 95.34 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.587 HD21 ' HG3' ' A' ' 103' ' ' MET . 20.2 tp -69.36 -50.34 47.18 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.684 -0.635 . . . . 0.0 110.219 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -58.35 -46.55 86.03 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.054 -1.028 . . . . 0.0 109.729 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.32 -42.34 98.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.373 -0.829 . . . . 0.0 110.408 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' A' ' 74' ' ' ASN . . . -68.12 -33.5 74.62 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.087 -1.008 . . . . 0.0 108.429 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.502 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 10.3 mt -64.67 -49.52 79.95 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.962 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.51 -38.22 86.57 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.78 75.82 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.711 ' ND2' ' NH1' ' A' ' 99' ' ' ARG . 29.6 p30 -94.13 -28.25 15.79 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.266 -1.137 . . . . 0.0 110.456 -179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.621 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 56.1 mtp180 -62.95 142.2 58.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.766 -1.209 . . . . 0.0 109.491 179.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -66.78 150.63 48.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.488 -0.758 . . . . 0.0 109.656 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -94.23 113.77 25.75 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.259 -0.9 . . . . 0.0 108.959 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.94 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.425 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.969 0 O4'-C1'-C2' 108.041 1.765 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.658 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C1'-C2' 108.821 2.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.211 0 O4'-C4'-C3' 107.48 1.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.149 0 O4'-C4'-C3' 107.779 2.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.221 0 O5'-C5'-C4' 113.161 2.115 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.11 0 O5'-C5'-C4' 113.053 2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.937 0 O5'-C5'-C4' 113.263 2.188 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.586 ' P ' ' O ' ' A' ' 48' ' ' ILE . . . . . . . . 0 C5'--C4' 1.521 1.311 0 O4'-C4'-C3' 107.647 2.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.364 0 O5'-C5'-C4' 113.344 2.246 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . 0.429 " H2'" ' H71' ' B' ' 411' ' ' ' DT' . . . . . . . . 0 P--O5' 1.615 2.195 0 O4'-C1'-C2' 108.554 2.231 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . 0.429 ' H71' " H2'" ' B' ' 410' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O5'-C5'-C4' 113.033 2.024 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.175 0 O5'-C5'-C4' 113.359 2.256 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O4'-C4'-C3' 107.905 2.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 O4'-C4'-C3' 107.56 1.96 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O4'-C4'-C3' 107.902 2.302 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.811 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.053 0 O4'-C1'-C2' 108.947 2.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.399 0 O4'-C1'-C2' 108.76 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.139 0 O5'-C5'-C4' 112.895 1.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.844 0 O5'-C5'-C4' 113.839 2.599 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . 0.534 ' OP1' ' NH1' ' A' ' 99' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -1.804 0 O4'-C4'-C3' 107.889 2.289 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.495 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.075 0 O4'-C4'-C3' 107.748 2.148 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.495 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.907 0 O5'-C5'-C4' 113.475 2.339 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.041 0 O5'-C5'-C4' 113.635 2.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.051 0 O4'-C1'-C2' 108.911 2.555 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.08 0 O5'-C5'-C4' 113.424 2.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.215 0 O4'-C4'-C3' 107.624 2.024 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.606 1.341 0 O4'-C4'-C3' 107.759 2.159 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.054 0 O4'-C4'-C3' 107.582 1.982 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.13 0 O5'-C5'-C4' 113.187 2.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.795 0 O4'-C4'-C3' 107.465 1.865 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CZ3' ' ND2' ' A' ' 44' ' ' ASN . 41.3 p90 -65.04 152.0 44.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.353 -1.086 . . . . 0.0 109.718 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 74.2 p -103.25 145.48 29.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.309 -0.869 . . . . 0.0 109.881 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.565 ' C ' ' CD1' ' A' ' 6' ' ' PHE . 0.1 OUTLIER -55.64 -41.88 74.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.634 -0.666 . . . . 0.0 110.449 -178.243 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' N ' ' CG ' ' A' ' 6' ' ' PHE . 96.4 mt-10 -61.83 -45.42 93.9 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.003 -1.061 . . . . 0.0 109.547 -179.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -61.38 -41.02 96.43 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.257 -0.902 . . . . 0.0 109.566 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.908 ' O ' HG12 ' A' ' 13' ' ' VAL . 9.4 mm-40 -74.46 -41.38 60.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.319 -0.863 . . . . 0.0 109.578 179.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -50.91 -47.44 60.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.271 -0.893 . . . . 0.0 109.535 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -61.36 -42.28 98.45 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.179 -0.951 . . . . 0.0 109.469 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -67.0 -51.53 53.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.179 -0.95 . . . . 0.0 111.194 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.908 HG12 ' O ' ' A' ' 9' ' ' GLN . 1.7 p -71.74 -39.61 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 120.986 -1.071 . . . . 0.0 110.256 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -58.92 -38.9 80.02 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.099 -1.626 . . . . 0.0 108.155 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.495 ' NE2' ' OE1' ' A' ' 18' ' ' GLU . 19.3 mm-40 -60.71 -31.32 70.61 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.648 178.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.547 ' HB3' HD13 ' A' ' 29' ' ' LEU . 9.4 mt -64.55 -39.15 93.23 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.458 -0.897 . . . . 0.0 110.734 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.412 ' OH ' ' OD1' ' A' ' 30' ' ' ASP . 94.1 m-85 -79.57 -34.98 40.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.561 -1.337 . . . . 0.0 109.835 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.495 ' OE1' ' NE2' ' A' ' 15' ' ' GLN . 97.7 mt-10 -64.8 -29.22 70.18 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.063 -1.023 . . . . 0.0 110.601 -178.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.53 HD12 ' HA ' ' A' ' 16' ' ' LEU . 16.5 mt -37.82 -39.94 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 121.518 -0.739 . . . . 0.0 110.897 -178.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.488 ' OD1' ' O ' ' A' ' 19' ' ' ILE . 0.9 OUTLIER -173.02 164.97 4.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.649 -1.282 . . . . 0.0 110.677 -179.159 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -92.14 67.18 4.99 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.838 -0.539 . . . . 0.0 110.078 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.33 102.87 54.14 Favored Pre-proline 0 N--CA 1.492 1.635 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -47.36 -48.83 14.25 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.952 1.768 . . . . 0.0 112.341 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 24' ' ' LYS . 0.9 OUTLIER -61.04 -37.1 81.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 120.996 -1.065 . . . . 0.0 108.919 179.421 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.642 HH11 ' HG2' ' A' ' 25' ' ' ARG . 1.2 ttt-85 -60.33 -42.89 96.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.306 -0.871 . . . . 0.0 109.439 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -62.22 -52.61 63.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.991 -1.068 . . . . 0.0 109.644 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -52.26 -35.04 48.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.425 -0.797 . . . . 0.0 109.288 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.98 -62.69 1.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.639 0.733 . . . . 0.0 110.549 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.547 HD13 ' HB3' ' A' ' 16' ' ' LEU . 14.6 mt -57.38 -43.21 83.42 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.643 -0.661 . . . . 0.0 109.365 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.412 ' OD1' ' OH ' ' A' ' 17' ' ' TYR . 96.5 m-20 -58.94 -50.75 72.88 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.211 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -66.99 -44.03 81.44 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.341 -0.85 . . . . 0.0 110.333 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.4 tp -57.96 -50.42 73.44 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.94 . . . . 0.0 110.381 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -60.85 -34.23 74.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.146 -1.422 . . . . 0.0 108.154 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -67.03 -54.66 19.49 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.336 -0.852 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -60.53 -38.98 86.17 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.661 -179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mmm -59.47 -39.41 83.59 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 111.512 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.427 ' NE2' ' HB3' ' A' ' 42' ' ' PRO . 85.2 mm-40 -63.32 -39.59 94.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.739 -1.225 . . . . 0.0 110.783 -179.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG3' ' H ' ' A' ' 38' ' ' LYS . 52.9 mttt -64.96 -44.05 90.66 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.031 -1.043 . . . . 0.0 109.509 -179.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.47 HH11 ' HB3' ' A' ' 108' ' ' PRO . 7.8 mtp180 -63.2 -25.47 68.35 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.963 -177.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 100.21 0.23 55.91 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 107.977 -2.049 . . . . 0.0 107.977 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 50.1 p -115.61 83.9 11.74 Favored Pre-proline 0 N--CA 1.49 1.56 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 178.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HB3' ' NE2' ' A' ' 37' ' ' GLN . 70.7 Cg_endo -85.08 142.73 8.86 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.647 2.232 . . . . 0.0 111.084 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.502 HG21 HD23 ' A' ' 46' ' ' LEU . 45.2 mt -78.88 94.53 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 C-N-CA 118.795 -1.162 . . . . 0.0 109.329 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.593 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 82.1 m-20 -65.97 -32.89 74.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -151.23 133.28 15.16 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.502 HD23 HG21 ' A' ' 43' ' ' ILE . 13.1 mt -71.45 146.76 92.08 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 120.784 -1.197 . . . . 0.0 109.267 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.54 104.16 1.76 Allowed 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 121.636 1.558 . . . . 0.0 109.735 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.598 HG22 ' OP1' ' B' ' 408' ' ' ' DT' . 50.2 mt -72.7 142.4 15.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 121.082 -1.011 . . . . 0.0 110.202 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.815 ' SD ' HG21 ' A' ' 97' ' ' THR . 64.9 mmm -138.51 127.96 24.61 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.782 0.801 . . . . 0.0 108.972 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.522 ' H ' HD11 ' A' ' 91' ' ' ILE . . . 63.32 40.04 8.94 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 -178.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 59.42 22.62 11.1 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.321 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.8 m -137.1 155.4 49.67 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.182 -0.949 . . . . 0.0 109.512 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 6.3 m -65.82 143.4 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 120.81 -1.181 . . . . 0.0 108.836 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.63 HD21 HD22 ' A' ' 59' ' ' LEU . 42.1 tp -77.76 124.45 27.97 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.17 -0.956 . . . . 0.0 109.135 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -65.17 91.64 0.1 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.569 -0.707 . . . . 0.0 110.045 -178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 24.3 mt -53.89 -25.14 18.59 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 120.99 -1.068 . . . . 0.0 108.848 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.48 ' CZ ' ' ND2' ' A' ' 61' ' ' ASN . 46.9 t80 -79.38 -57.85 3.5 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 111.685 -178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.13 -39.25 91.92 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.659 -1.276 . . . . 0.0 110.153 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.63 HD22 HD21 ' A' ' 54' ' ' LEU . 60.7 tp -60.02 -40.98 91.15 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.829 -1.169 . . . . 0.0 108.352 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.409 ' CE2' HG13 ' A' ' 64' ' ' ILE . 47.6 t80 -61.56 -67.17 0.43 Allowed 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.48 ' ND2' ' CZ ' ' A' ' 57' ' ' TYR . 88.0 m-20 -43.06 -39.75 2.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.482 -0.761 . . . . 0.0 111.123 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' O ' ' NH1' ' A' ' 66' ' ' ARG . 4.5 mt -70.21 -46.58 64.25 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 117.656 -1.618 . . . . 0.0 107.356 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.902 HG21 ' CE2' ' A' ' 102' ' ' TYR . 33.8 t -57.61 -44.49 85.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 110.566 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.499 HG23 HD11 ' A' ' 116' ' ' LEU . 10.9 mm -70.16 -34.2 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 120.508 -1.37 . . . . 0.0 108.007 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.18 -20.44 26.62 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.82 -0.55 . . . . 0.0 110.232 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.587 HH21 ' CB ' ' A' ' 80' ' ' GLU . 14.6 mmt-85 -94.53 2.07 55.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.713 -1.242 . . . . 0.0 108.732 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.97 14.4 77.37 Favored Glycine 0 N--CA 1.493 2.438 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.154 177.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 139.02 132.61 2.96 Favored Glycine 0 N--CA 1.501 2.974 0 O-C-N 120.519 -1.577 . . . . 0.0 111.316 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.503 HD11 ' CH2' ' A' ' 78' ' ' TRP . 19.7 tp -50.11 -40.91 47.34 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.65 -0.912 . . . . 0.0 110.754 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.549 HG22 ' HA ' ' A' ' 122' ' ' LEU . 76.3 t -58.99 -41.54 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.903 -1.123 . . . . 0.0 109.863 -179.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -56.4 -39.84 73.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.995 -1.065 . . . . 0.0 108.877 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 76' ' ' LYS . 98.2 t -64.99 -44.26 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.544 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.402 HD12 ' CD1' ' A' ' 122' ' ' LEU . 43.8 mt -67.44 -52.54 40.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.821 0 O-C-N 120.862 -1.149 . . . . 0.0 110.01 -178.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.473 HD21 ' CB ' ' A' ' 125' ' ' ALA . 4.5 m120 -57.73 -42.97 84.95 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.995 -1.066 . . . . 0.0 110.35 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -94.94 -8.88 35.75 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 72' ' ' VAL . 37.7 mtmt 59.04 60.69 2.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.338 -0.851 . . . . 0.0 109.703 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.413 HD13 ' HD2' ' A' ' 66' ' ' ARG . 14.7 mt -90.9 17.63 7.59 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.503 ' CH2' HD11 ' A' ' 69' ' ' LEU . 97.9 m95 -64.48 -43.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.449 -0.782 . . . . 0.0 109.537 179.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 78' ' ' TRP . 50.8 mt-30 -48.21 -38.83 19.31 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 118.254 -1.379 . . . . 0.0 108.35 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.587 ' CB ' HH21 ' A' ' 66' ' ' ARG . 77.0 mm-40 -66.39 -40.79 89.87 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 178.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' A' ' 78' ' ' TRP . 5.2 mt -72.41 -52.32 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.568 HD11 ' HB2' ' A' ' 95' ' ' ALA . 45.9 mt -52.96 -52.55 27.86 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -72.3 -40.7 67.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.479 -0.763 . . . . 0.0 109.899 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 80' ' ' GLU . . . -52.75 -34.87 45.24 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 78.8 mt -89.71 -7.96 53.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.373 -1.075 . . . . 0.0 108.888 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 22.4 m-70 67.22 38.5 3.33 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.34 0.591 . . . . 0.0 109.546 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.66 120.08 78.73 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.407 -0.808 . . . . 0.0 108.967 178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.481 ' C ' ' H ' ' A' ' 90' ' ' SER . 50.8 Cg_exo -47.79 139.16 19.51 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.767 1.645 . . . . 0.0 112.694 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 83.4 p -60.84 0.91 0.17 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.344 -0.848 . . . . 0.0 109.887 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.481 ' H ' ' C ' ' A' ' 88' ' ' PRO . 6.0 m -62.7 -33.04 74.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.146 -0.971 . . . . 0.0 109.503 -178.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.522 HD11 ' H ' ' A' ' 50' ' ' ALA . 85.7 mt -87.2 101.12 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 120.826 -1.171 . . . . 0.0 108.937 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 39.1 p -68.18 -29.31 68.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.311 -0.868 . . . . 0.0 109.132 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -94.79 39.96 1.1 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.53 -0.731 . . . . 0.0 109.067 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.77 -64.62 0.86 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.14 -0.975 . . . . 0.0 108.931 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.568 ' HB2' HD11 ' A' ' 82' ' ' ILE . . . -48.43 -51.98 24.22 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.342 -0.849 . . . . 0.0 109.6 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.519 HD12 ' NH2' ' A' ' 99' ' ' ARG . 6.8 tp -58.61 -47.38 84.52 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.732 -1.23 . . . . 0.0 109.628 -179.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.815 HG21 ' SD ' ' A' ' 49' ' ' MET . 58.1 m -59.51 -40.1 86.02 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.032 -1.043 . . . . 0.0 108.842 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.404 ' HB3' ' CZ3' ' A' ' 78' ' ' TRP . 9.6 mt -71.05 -45.45 63.81 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.659 -0.651 . . . . 0.0 110.255 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.519 ' NH2' HD12 ' A' ' 96' ' ' LEU . 9.1 tmm_? -67.28 -50.67 59.42 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.841 -1.162 . . . . 0.0 110.952 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 16.3 m -55.99 -54.8 40.52 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.163 -0.961 . . . . 0.0 110.081 -178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -61.99 -40.57 96.07 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.105 -0.997 . . . . 0.0 111.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.902 ' CE2' HG21 ' A' ' 63' ' ' VAL . 6.8 t80 -57.58 -39.82 77.62 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.21 -1.556 . . . . 0.0 109.402 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.572 ' HG3' HD21 ' A' ' 122' ' ' LEU . 1.7 ttm -55.58 -55.94 26.16 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.393 -0.817 . . . . 0.0 112.246 -178.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -72.85 -52.05 16.34 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.627 -1.296 . . . . 0.0 112.823 -176.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.505 ' C ' HD12 ' A' ' 106' ' ' LEU . 58.6 m-85 -83.69 -43.19 15.8 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -175.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 106' ' ' LEU . 10.0 mp -99.63 -7.25 26.0 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.283 -1.511 . . . . 0.0 114.238 -176.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.652 ' N ' ' CD ' ' A' ' 108' ' ' PRO . 46.5 t80 -62.3 -36.92 31.94 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 119.686 -1.884 . . . . 0.0 109.727 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.652 ' CD ' ' N ' ' A' ' 107' ' ' TYR . 21.9 Cg_exo -65.69 -56.81 0.29 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.242 1.961 . . . . 0.0 112.091 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.31 -35.93 74.7 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -71.8 -56.21 6.17 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.732 -0.605 . . . . 0.0 110.309 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 115' ' ' ASN . 0.5 OUTLIER -69.96 -41.53 74.36 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.304 -0.872 . . . . 0.0 110.1 -178.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 108' ' ' PRO . 45.4 tp10 -66.57 -49.52 66.12 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.261 -0.9 . . . . 0.0 110.799 -178.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -74.67 -30.22 61.52 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.088 -1.008 . . . . 0.0 111.513 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG2' HD21 ' A' ' 116' ' ' LEU . 40.2 tptt -125.35 -27.63 3.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.004 -1.06 . . . . 0.0 112.115 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' A' ' 111' ' ' CYS . 29.9 t30 57.04 45.42 21.05 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.579 -1.326 . . . . 0.0 110.065 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.499 HD11 HG23 ' A' ' 64' ' ' ILE . 78.7 mt -67.55 -33.24 74.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.116 -0.99 . . . . 0.0 111.431 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.568 ' OG ' ' N ' ' A' ' 118' ' ' THR . 27.6 t -154.28 -166.11 2.27 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.598 -1.241 . . . . 0.0 111.75 -178.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.568 ' N ' ' OG ' ' A' ' 117' ' ' SER . 81.9 p -124.67 152.24 68.88 Favored Pre-proline 0 N--CA 1.497 1.88 0 O-C-N 121.888 -0.508 . . . . 0.0 109.754 -178.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.66 -38.71 91.08 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.2 1.933 . . . . 0.0 112.326 179.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.65 88.11 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.874 -1.141 . . . . 0.0 109.427 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -65.78 -42.09 91.2 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 178.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 103' ' ' MET . 13.0 tp -67.56 -51.72 47.24 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.686 -0.634 . . . . 0.0 109.871 178.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.7 mm-40 -56.12 -45.67 79.44 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.948 -1.095 . . . . 0.0 108.289 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.35 89.04 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.421 -0.799 . . . . 0.0 109.201 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.473 ' CB ' HD21 ' A' ' 74' ' ' ASN . . . -67.76 -36.63 80.87 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.527 ' O ' ' OD1' ' A' ' 129' ' ' ASN . 6.9 mt -64.1 -48.72 84.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.876 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.424 ' HA ' ' HE ' ' A' ' 130' ' ' ARG . 58.1 t0 -62.22 -37.64 86.15 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.957 -1.09 . . . . 0.0 108.256 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -61.65 -33.27 84.43 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.626 -0.99 . . . . 0.0 110.626 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.641 ' OD1' ' N ' ' A' ' 130' ' ' ARG . 28.1 p-10 -92.27 -31.63 15.33 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.9 -1.353 . . . . 0.0 110.424 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.641 ' N ' ' OD1' ' A' ' 129' ' ' ASN . 81.8 mtm180 -64.24 144.48 57.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.613 -1.305 . . . . 0.0 109.418 179.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.577 ' CD ' ' N ' ' A' ' 131' ' ' ARG . 9.5 mpt_? -67.93 149.04 50.27 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.255 -0.903 . . . . 0.0 109.657 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -69.35 -10.54 58.35 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.879 0.847 . . . . 0.0 109.228 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.951 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 401' ' ' ' DC' . . . . . 0.438 " H2'" ' C6 ' ' B' ' 402' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.426 -1.777 0 O4'-C1'-C2' 107.843 1.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 402' ' ' ' DC' . . . . . 0.579 ' H6 ' " O5'" ' B' ' 402' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.225 0 O4'-C1'-C2' 108.611 2.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 403' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.136 0 O4'-C4'-C3' 107.546 1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 404' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.424 0 O4'-C4'-C3' 107.78 2.18 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 405' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.115 0 O5'-C5'-C4' 112.962 1.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 406' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.096 0 O5'-C5'-C4' 113.043 2.031 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 407' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.914 0 O5'-C5'-C4' 113.33 2.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 408' ' ' ' DT' . . . . . 0.598 ' OP1' HG22 ' A' ' 48' ' ' ILE . . . . . . . . 0 P--O5' 1.606 1.268 0 C4'-C3'-C2' 105.3 2.1 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 409' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.256 0 O5'-C5'-C4' 113.201 2.143 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 410' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.304 0 O5'-C5'-C4' 113.255 2.182 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 411' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.823 0 O5'-C5'-C4' 113.237 2.169 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 412' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.303 0 O5'-C5'-C4' 113.541 2.386 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 413' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.273 0 O4'-C4'-C3' 107.894 2.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 414' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.9 0 O4'-C4'-C3' 107.642 2.042 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 415' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.975 0 O4'-C4'-C3' 108.088 2.488 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 416' ' ' ' DC' . . . . . 0.816 ' H6 ' " O5'" ' C' ' 416' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.966 0 O4'-C1'-C2' 109.025 2.659 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 417' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.402 0 O4'-C1'-C2' 108.702 2.365 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 418' ' ' ' DA' . . . . . 0.471 ' C5 ' ' C4 ' ' C' ' 419' ' ' ' DC' . . . . . . . . 0 P--O5' 1.614 2.111 0 O5'-C5'-C4' 112.859 1.899 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 419' ' ' ' DC' . . . . . 0.471 ' C4 ' ' C5 ' ' C' ' 418' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.717 0 O5'-C5'-C4' 113.975 2.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 420' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.871 0 O4'-C4'-C3' 107.736 2.136 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 421' ' ' ' DT' . . . . . 0.457 ' C4 ' ' N4 ' ' C' ' 422' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.092 0 O5'-C5'-C4' 113.059 2.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 422' ' ' ' DC' . . . . . 0.457 ' N4 ' ' C4 ' ' C' ' 421' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.101 0 O5'-C5'-C4' 113.691 2.493 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 423' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.611 1.805 0 O5'-C5'-C4' 113.49 2.35 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 424' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.187 0 O4'-C1'-C2' 108.686 2.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 425' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.32 0 O4'-C4'-C3' 108.066 2.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 426' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.135 0 O4'-C4'-C3' 107.701 2.101 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 427' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.607 1.351 0 O4'-C4'-C3' 107.741 2.141 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 428' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.976 0 O4'-C4'-C3' 107.613 2.013 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 429' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.897 0 O4'-C4'-C3' 107.899 2.299 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 430' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.71 0 O4'-C4'-C3' 107.611 2.011 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_