data_1lc1_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 1lc1 _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 full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.82 0 CA-C-O 118.638 -1.09 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -137.97 159.04 43.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.413 1.085 . . . . 0.0 113.062 -165.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -64.09 -52.82 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.2 1.4 . . . . 0.0 109.72 174.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -50.77 -55.2 17.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 127.899 2.479 . . . . 0.0 112.487 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -52.8 -29.34 27.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.478 1.111 . . . . 0.0 113.334 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.85 -50.71 4.81 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 -177.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -62.21 -42.19 99.07 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.026 0.913 . . . . 0.0 112.484 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -43.22 96.08 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.927 0.785 . . . . 0.0 112.686 178.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 6.9 tp -75.16 -31.75 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 119.015 0.825 . . . . 0.0 112.066 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.6 t80 -58.3 -49.85 75.68 Favored 'General case' 0 C--N 1.341 0.202 0 O-C-N 121.631 -0.668 . . . . 0.0 110.573 169.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.23 -14.42 12.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 121.206 -0.934 . . . . 0.0 113.147 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -92.61 -50.85 5.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.565 1.146 . . . . 0.0 111.852 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -106.83 -11.91 15.63 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 23.5 m -121.46 -48.26 2.19 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 124.683 1.193 . . . . 0.0 111.561 -167.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.57 -19.49 57.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.97 -17.55 1.05 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 131.059 3.744 . . . . 0.0 114.065 166.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 55.4 m -141.58 -41.31 0.37 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.832 2.053 . . . . 0.0 111.141 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -104.11 70.22 0.97 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 129.155 2.982 . . . . 0.0 111.072 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -76.11 57.22 1.08 Allowed 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.969 -1.082 . . . . 0.0 112.108 -173.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.3 p -75.46 -37.05 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 127.255 2.222 . . . . 0.0 112.405 176.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -70.55 -19.84 62.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.396 1.478 . . . . 0.0 114.301 -163.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -152.71 123.98 7.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.453 1.901 . . . . 0.0 108.478 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.98 37.24 94.09 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 118.489 -1.173 . . . . 0.0 113.843 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -4.89 106.93 0.01 OUTLIER Glycine 0 C--N 1.343 0.971 0 C-N-CA 129.823 3.582 . . . . 0.0 117.1 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -160.26 173.99 14.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.851 2.061 . . . . 0.0 110.861 -164.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -151.89 101.81 2.78 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.224 1.41 . . . . 0.0 109.867 -166.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -95.5 -38.41 10.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.714 1.206 . . . . 0.0 112.069 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -154.02 3.91 0.27 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.218 1.007 . . . . 0.0 112.112 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -143.92 163.53 27.67 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 159.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.98 159.95 50.69 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 122.772 2.315 . . . . 0.0 112.327 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.63 132.27 49.27 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.046 -1.034 . . . . 0.0 108.916 163.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.32 62.81 0.99 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.884 1.326 . . . . 0.0 111.646 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 89.4 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 130.397 3.479 . . . . 0.0 113.474 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.22 36.79 77.1 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.903 1.716 . . . . 0.0 114.065 169.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.15 -44.76 92.11 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -154.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.415 ' CD2' ' HE3' ' A' ' 99' ' ' LYS . 9.6 m-85 -67.16 103.2 1.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.92 0.867 . . . . 0.0 112.472 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.09 -19.87 22.28 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 128.723 3.058 . . . . 0.0 113.381 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtm105 -87.27 167.81 13.76 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.997 1.319 . . . . 0.0 114.405 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -84.39 161.63 20.29 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.042 1.337 . . . . 0.0 113.547 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.1 t -77.53 171.3 15.11 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.826 1.251 . . . . 0.0 110.159 159.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.62 46.79 6.64 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.273 0.94 . . . . 0.0 112.739 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -139.2 -5.88 1.42 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -163.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.04 142.82 85.6 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 119.96 1.254 . . . . 0.0 112.015 -177.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -79.59 65.72 8.85 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.516 2.811 . . . . 0.0 111.989 -174.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 99.14 -6.03 59.56 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.156 1.36 . . . . 0.0 115.155 174.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -63.66 98.04 0.17 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.641 1.22 . . . . 0.0 109.875 175.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -85.25 80.19 9.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.245 1.021 . . . . 0.0 110.529 -163.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.4 178.84 7.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.553 2.341 . . . . 0.0 112.765 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.3 p -65.95 155.15 37.39 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.771 1.228 . . . . 0.0 112.383 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.73 -42.33 82.06 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -173.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.99 79.68 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.876 1.27 . . . . 0.0 114.274 -164.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -56.22 -66.24 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.108 0.867 . . . . 0.0 110.294 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -46.52 68.56 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.527 0.731 . . . . 0.0 110.639 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -59.1 -38.79 80.38 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.47 1.508 . . . . 0.0 111.194 -176.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.96 -20.11 64.19 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.2 11.08 31.12 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 118.179 2.032 . . . . 0.0 118.179 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -54.37 -4.23 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 119.053 2.982 . . . . 0.0 119.053 -160.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.6 m 56.69 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 128.307 2.643 . . . . 0.0 114.839 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.459 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 35.8 m95 -76.13 123.96 26.66 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 113.07 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -164.22 178.57 7.47 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.787 2.435 . . . . 0.0 108.822 176.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -48.23 -54.81 12.25 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.468 1.107 . . . . 0.0 113.138 -177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -54.95 -53.02 60.95 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.708 1.203 . . . . 0.0 112.35 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 52.6 p -74.0 -36.71 64.53 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 123.766 0.827 . . . . 0.0 111.612 -170.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.73 -24.33 56.15 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 171.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.3 mtm -62.99 -57.33 11.1 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 119.205 0.912 . . . . 0.0 110.066 166.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -64.67 -37.92 89.21 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.78 0.675 . . . . 0.0 110.752 -177.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.07 -64.61 0.82 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.934 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.96 -18.67 64.81 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.637 1.562 . . . . 0.0 113.975 -173.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -76.86 -26.65 54.5 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 166.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.22 56.18 0.55 Allowed Pre-proline 0 CA--C 1.562 1.408 0 CA-C-N 119.457 1.026 . . . . 0.0 112.209 -160.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.55 -51.4 0.53 Allowed 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.5 1.467 . . . . 0.0 113.001 -155.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.11 -18.41 63.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.236 1.814 . . . . 0.0 113.799 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 ttpt -75.58 -52.9 9.54 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.926 0.89 . . . . 0.0 109.976 164.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -61.82 -44.8 96.12 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.82 123.37 16.01 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.842 1.257 . . . . 0.0 109.656 170.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.84 160.32 47.31 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.068 1.845 . . . . 0.0 111.002 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.89 3.86 45.2 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 118.46 -1.189 . . . . 0.0 115.826 175.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.6 m -62.03 120.13 10.24 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.011 1.905 . . . . 0.0 110.951 168.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -87.5 16.69 5.2 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.6 ttt -64.07 94.57 0.11 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.152 0.981 . . . . 0.0 112.172 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.7 mt -73.43 69.52 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.816 1.646 . . . . 0.0 110.2 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -163.38 -37.97 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.551 1.141 . . . . 0.0 113.462 178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.91 -17.68 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 121.235 3.791 . . . . 0.0 121.235 178.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -173.43 157.36 25.96 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 122.246 2.293 . . . . 0.0 113.246 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.3 tt -90.27 -57.0 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -162.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.4 mttt 160.93 -84.09 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 131.548 3.939 . . . . 0.0 108.741 167.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -77.13 133.03 39.11 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.197 2.199 . . . . 0.0 109.703 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -60.48 -18.25 50.33 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 171.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 95.8 m -78.18 -31.5 49.61 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.152 -1.404 . . . . 0.0 113.875 170.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -60.26 -37.67 81.14 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 121.65 2.023 . . . . 0.0 109.777 165.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -48.28 82.36 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.832 1.653 . . . . 0.0 111.612 173.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -54.5 -53.37 55.21 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.255 0.934 . . . . 0.0 111.328 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -61.85 -37.34 84.13 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.224 1.41 . . . . 0.0 111.64 -171.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.32 -43.96 88.4 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 113.066 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.6 mm -63.44 -46.92 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.716 0.689 . . . . 0.0 109.87 173.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.31 -47.49 78.61 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.535 0.734 . . . . 0.0 112.247 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.46 -57.16 13.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.936 1.294 . . . . 0.0 111.981 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.9 mt -74.96 -20.02 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.367 0.985 . . . . 0.0 113.626 -171.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.415 ' HE3' ' CD2' ' A' ' 36' ' ' PHE . 3.0 tpmt? -57.68 -43.28 84.94 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.443 1.097 . . . . 0.0 111.465 161.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -75.13 -43.99 49.55 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.676 1.191 . . . . 0.0 112.714 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.45 -8.68 1.27 Allowed 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 -168.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.1 t -101.15 9.73 41.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.759 1.224 . . . . 0.0 114.171 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -153.87 -10.12 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.47 2.308 . . . . 0.0 114.434 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--O 1.249 1.077 0 C-N-CA 127.613 2.365 . . . . 0.0 110.369 -173.153 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HEC . . . . . 0.459 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.82 0 CA-C-O 118.638 -1.09 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -137.97 159.04 43.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.413 1.085 . . . . 0.0 113.062 -165.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -64.09 -52.82 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.2 1.4 . . . . 0.0 109.72 174.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -50.77 -55.2 17.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 127.899 2.479 . . . . 0.0 112.487 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -52.8 -29.34 27.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.478 1.111 . . . . 0.0 113.334 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.85 -50.71 4.81 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 -177.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -62.21 -42.19 99.07 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.026 0.913 . . . . 0.0 112.484 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -43.22 96.08 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.927 0.785 . . . . 0.0 112.686 178.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 6.9 tp -75.16 -31.75 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 119.015 0.825 . . . . 0.0 112.066 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.6 t80 -58.3 -49.85 75.68 Favored 'General case' 0 C--N 1.341 0.202 0 O-C-N 121.631 -0.668 . . . . 0.0 110.573 169.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.23 -14.42 12.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 121.206 -0.934 . . . . 0.0 113.147 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -92.61 -50.85 5.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.565 1.146 . . . . 0.0 111.852 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -106.83 -11.91 15.63 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.452 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 23.5 m -121.46 -48.26 2.19 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 124.683 1.193 . . . . 0.0 111.561 -167.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.57 -19.49 57.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.97 -17.55 1.05 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 131.059 3.744 . . . . 0.0 114.065 166.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 55.4 m -141.58 -41.31 0.37 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.832 2.053 . . . . 0.0 111.141 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -104.11 70.22 0.97 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 129.155 2.982 . . . . 0.0 111.072 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -76.11 57.22 1.08 Allowed 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.969 -1.082 . . . . 0.0 112.108 -173.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.3 p -75.46 -37.05 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 127.255 2.222 . . . . 0.0 112.405 176.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -70.55 -19.84 62.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.396 1.478 . . . . 0.0 114.301 -163.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -152.71 123.98 7.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.453 1.901 . . . . 0.0 108.478 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.98 37.24 94.09 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 118.489 -1.173 . . . . 0.0 113.843 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -4.89 106.93 0.01 OUTLIER Glycine 0 C--N 1.343 0.971 0 C-N-CA 129.823 3.582 . . . . 0.0 117.1 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -160.26 173.99 14.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.851 2.061 . . . . 0.0 110.861 -164.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -151.89 101.81 2.78 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.224 1.41 . . . . 0.0 109.867 -166.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -95.5 -38.41 10.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.714 1.206 . . . . 0.0 112.069 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -154.02 3.91 0.27 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.218 1.007 . . . . 0.0 112.112 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -143.92 163.53 27.67 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 159.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.98 159.95 50.69 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 122.772 2.315 . . . . 0.0 112.327 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.63 132.27 49.27 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.046 -1.034 . . . . 0.0 108.916 163.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.32 62.81 0.99 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.884 1.326 . . . . 0.0 111.646 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 89.4 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 130.397 3.479 . . . . 0.0 113.474 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.22 36.79 77.1 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.903 1.716 . . . . 0.0 114.065 169.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.15 -44.76 92.11 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -154.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.444 ' CD2' ' HE3' ' A' ' 99' ' ' LYS . 9.6 m-85 -67.16 103.2 1.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.92 0.867 . . . . 0.0 112.472 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.09 -19.87 22.28 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 128.723 3.058 . . . . 0.0 113.381 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtm105 -87.27 167.81 13.76 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.997 1.319 . . . . 0.0 114.405 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -84.39 161.63 20.29 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.042 1.337 . . . . 0.0 113.547 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.1 t -77.53 171.3 15.11 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.826 1.251 . . . . 0.0 110.159 159.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.62 46.79 6.64 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.273 0.94 . . . . 0.0 112.739 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -139.2 -5.88 1.42 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -163.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.04 142.82 85.6 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 119.96 1.254 . . . . 0.0 112.015 -177.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -79.59 65.72 8.85 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.516 2.811 . . . . 0.0 111.989 -174.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 99.14 -6.03 59.56 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.156 1.36 . . . . 0.0 115.155 174.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -63.66 98.04 0.17 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.641 1.22 . . . . 0.0 109.875 175.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -85.25 80.19 9.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.245 1.021 . . . . 0.0 110.529 -163.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.4 178.84 7.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.553 2.341 . . . . 0.0 112.765 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.3 p -65.95 155.15 37.39 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.771 1.228 . . . . 0.0 112.383 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.73 -42.33 82.06 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -173.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.99 79.68 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.876 1.27 . . . . 0.0 114.274 -164.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -56.22 -66.24 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.108 0.867 . . . . 0.0 110.294 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.402 ' HD3' ' H ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -53.05 -46.52 68.56 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.527 0.731 . . . . 0.0 110.639 -178.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -59.1 -38.79 80.38 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.47 1.508 . . . . 0.0 111.194 -176.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.96 -20.11 64.19 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.2 11.08 31.12 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 118.179 2.032 . . . . 0.0 118.179 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -54.37 -4.23 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 119.053 2.982 . . . . 0.0 119.053 -160.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.6 m 56.69 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 128.307 2.643 . . . . 0.0 114.839 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.4 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 35.8 m95 -76.13 123.96 26.66 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 113.07 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -164.22 178.57 7.47 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.787 2.435 . . . . 0.0 108.822 176.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -48.23 -54.81 12.25 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.468 1.107 . . . . 0.0 113.138 -177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -54.95 -53.02 60.95 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.708 1.203 . . . . 0.0 112.35 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 52.6 p -74.0 -36.71 64.53 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 123.766 0.827 . . . . 0.0 111.612 -170.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.73 -24.33 56.15 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 171.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.3 mtm -62.99 -57.33 11.1 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 119.205 0.912 . . . . 0.0 110.066 166.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -64.67 -37.92 89.21 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.78 0.675 . . . . 0.0 110.752 -177.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.07 -64.61 0.82 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.934 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.96 -18.67 64.81 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.637 1.562 . . . . 0.0 113.975 -173.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -76.86 -26.65 54.5 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 166.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.22 56.18 0.55 Allowed Pre-proline 0 CA--C 1.562 1.408 0 CA-C-N 119.457 1.026 . . . . 0.0 112.209 -160.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.55 -51.4 0.53 Allowed 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.5 1.467 . . . . 0.0 113.001 -155.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.11 -18.41 63.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.236 1.814 . . . . 0.0 113.799 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 ttpt -75.58 -52.9 9.54 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.926 0.89 . . . . 0.0 109.976 164.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -61.82 -44.8 96.12 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.82 123.37 16.01 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.842 1.257 . . . . 0.0 109.656 170.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.84 160.32 47.31 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.068 1.845 . . . . 0.0 111.002 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.89 3.86 45.2 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 118.46 -1.189 . . . . 0.0 115.826 175.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.6 m -62.03 120.13 10.24 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.011 1.905 . . . . 0.0 110.951 168.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -87.5 16.69 5.2 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.6 ttt -64.07 94.57 0.11 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.152 0.981 . . . . 0.0 112.172 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.7 mt -73.43 69.52 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.816 1.646 . . . . 0.0 110.2 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -163.38 -37.97 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.551 1.141 . . . . 0.0 113.462 178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.91 -17.68 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 121.235 3.791 . . . . 0.0 121.235 178.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -173.43 157.36 25.96 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 122.246 2.293 . . . . 0.0 113.246 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.3 tt -90.27 -57.0 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -162.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.4 mttt 160.93 -84.09 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 131.548 3.939 . . . . 0.0 108.741 167.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -77.13 133.03 39.11 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.197 2.199 . . . . 0.0 109.703 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -60.48 -18.25 50.33 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 171.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 95.8 m -78.18 -31.5 49.61 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.152 -1.404 . . . . 0.0 113.875 170.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -60.26 -37.67 81.14 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 121.65 2.023 . . . . 0.0 109.777 165.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -48.28 82.36 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.832 1.653 . . . . 0.0 111.612 173.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -54.5 -53.37 55.21 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.255 0.934 . . . . 0.0 111.328 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -61.85 -37.34 84.13 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.224 1.41 . . . . 0.0 111.64 -171.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.32 -43.96 88.4 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 113.066 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.6 mm -63.44 -46.92 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.716 0.689 . . . . 0.0 109.87 173.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.31 -47.49 78.61 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.535 0.734 . . . . 0.0 112.247 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.46 -57.16 13.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.936 1.294 . . . . 0.0 111.981 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.9 mt -74.96 -20.02 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.367 0.985 . . . . 0.0 113.626 -171.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' HE3' ' CD2' ' A' ' 36' ' ' PHE . 3.0 tpmt? -57.68 -43.28 84.94 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.443 1.097 . . . . 0.0 111.465 161.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -75.13 -43.99 49.55 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.676 1.191 . . . . 0.0 112.714 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.45 -8.68 1.27 Allowed 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 -168.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.1 t -101.15 9.73 41.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.759 1.224 . . . . 0.0 114.171 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -153.87 -10.12 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.47 2.308 . . . . 0.0 114.434 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--O 1.249 1.077 0 C-N-CA 127.613 2.365 . . . . 0.0 110.369 -173.153 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HEC . . . . . 0.4 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.82 0 CA-C-O 118.638 -1.09 . . . . 0.0 110.551 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -137.97 159.04 43.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.413 1.085 . . . . 0.0 113.062 -165.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -64.09 -52.82 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.2 1.4 . . . . 0.0 109.72 174.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -50.77 -55.2 17.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 127.899 2.479 . . . . 0.0 112.487 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -52.8 -29.34 27.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.478 1.111 . . . . 0.0 113.334 173.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.85 -50.71 4.81 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 -177.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.9 pttt -62.21 -42.19 99.07 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.026 0.913 . . . . 0.0 112.484 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -43.22 96.08 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.927 0.785 . . . . 0.0 112.686 178.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 6.9 tp -75.16 -31.75 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 119.015 0.825 . . . . 0.0 112.066 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 31.6 t80 -58.3 -49.85 75.68 Favored 'General case' 0 C--N 1.341 0.202 0 O-C-N 121.631 -0.668 . . . . 0.0 110.573 169.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.23 -14.42 12.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 O-C-N 121.206 -0.934 . . . . 0.0 113.147 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 -92.61 -50.85 5.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.565 1.146 . . . . 0.0 111.852 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -106.83 -11.91 15.63 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.452 ' SG ' ' HA ' ' A' ' 10' ' ' PHE . 23.5 m -121.46 -48.26 2.19 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 124.683 1.193 . . . . 0.0 111.561 -167.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.57 -19.49 57.7 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.97 -17.55 1.05 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 131.059 3.744 . . . . 0.0 114.065 166.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 55.4 m -141.58 -41.31 0.37 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.832 2.053 . . . . 0.0 111.141 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -104.11 70.22 0.97 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 129.155 2.982 . . . . 0.0 111.072 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -76.11 57.22 1.08 Allowed 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.969 -1.082 . . . . 0.0 112.108 -173.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.3 p -75.46 -37.05 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 127.255 2.222 . . . . 0.0 112.405 176.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -70.55 -19.84 62.85 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.396 1.478 . . . . 0.0 114.301 -163.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -152.71 123.98 7.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.453 1.901 . . . . 0.0 108.478 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.98 37.24 94.09 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 118.489 -1.173 . . . . 0.0 113.843 179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -4.89 106.93 0.01 OUTLIER Glycine 0 C--N 1.343 0.971 0 C-N-CA 129.823 3.582 . . . . 0.0 117.1 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -160.26 173.99 14.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 126.851 2.061 . . . . 0.0 110.861 -164.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -151.89 101.81 2.78 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.224 1.41 . . . . 0.0 109.867 -166.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -95.5 -38.41 10.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.714 1.206 . . . . 0.0 112.069 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -154.02 3.91 0.27 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.218 1.007 . . . . 0.0 112.112 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -143.92 163.53 27.67 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 159.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.98 159.95 50.69 Favored 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 122.772 2.315 . . . . 0.0 112.327 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.63 132.27 49.27 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.046 -1.034 . . . . 0.0 108.916 163.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 mp -74.32 62.81 0.99 Allowed 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 122.884 1.326 . . . . 0.0 111.646 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.64 89.4 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 130.397 3.479 . . . . 0.0 113.474 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 57.22 36.79 77.1 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.903 1.716 . . . . 0.0 114.065 169.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.15 -44.76 92.11 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -154.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.444 ' CD2' ' HE3' ' A' ' 99' ' ' LYS . 9.6 m-85 -67.16 103.2 1.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.92 0.867 . . . . 0.0 112.472 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.09 -19.87 22.28 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 128.723 3.058 . . . . 0.0 113.381 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtm105 -87.27 167.81 13.76 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.997 1.319 . . . . 0.0 114.405 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -84.39 161.63 20.29 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.042 1.337 . . . . 0.0 113.547 173.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.1 t -77.53 171.3 15.11 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.826 1.251 . . . . 0.0 110.159 159.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.62 46.79 6.64 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.273 0.94 . . . . 0.0 112.739 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -139.2 -5.88 1.42 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -163.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.04 142.82 85.6 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 119.96 1.254 . . . . 0.0 112.015 -177.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -79.59 65.72 8.85 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.516 2.811 . . . . 0.0 111.989 -174.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 99.14 -6.03 59.56 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.156 1.36 . . . . 0.0 115.155 174.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -63.66 98.04 0.17 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.641 1.22 . . . . 0.0 109.875 175.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 88.1 m -85.25 80.19 9.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.245 1.021 . . . . 0.0 110.529 -163.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.4 178.84 7.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.553 2.341 . . . . 0.0 112.765 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.3 p -65.95 155.15 37.39 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.771 1.228 . . . . 0.0 112.383 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.73 -42.33 82.06 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -173.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.73 -35.99 79.68 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.876 1.27 . . . . 0.0 114.274 -164.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -56.22 -66.24 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.108 0.867 . . . . 0.0 110.294 177.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.402 ' HD3' ' H ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -53.05 -46.52 68.56 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.527 0.731 . . . . 0.0 110.639 -178.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -59.1 -38.79 80.38 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.47 1.508 . . . . 0.0 111.194 -176.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.96 -20.11 64.19 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.2 11.08 31.12 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 118.179 2.032 . . . . 0.0 118.179 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 pp -54.37 -4.23 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 119.053 2.982 . . . . 0.0 119.053 -160.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.6 m 56.69 117.73 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 128.307 2.643 . . . . 0.0 114.839 -175.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.4 ' HE1' ' CGA' ' A' ' 105' ' ' HEC . 35.8 m95 -76.13 123.96 26.66 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 113.07 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -164.22 178.57 7.47 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.787 2.435 . . . . 0.0 108.822 176.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -48.23 -54.81 12.25 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.468 1.107 . . . . 0.0 113.138 -177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -54.95 -53.02 60.95 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.708 1.203 . . . . 0.0 112.35 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 52.6 p -74.0 -36.71 64.53 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 123.766 0.827 . . . . 0.0 111.612 -170.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.73 -24.33 56.15 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 171.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.3 mtm -62.99 -57.33 11.1 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 119.205 0.912 . . . . 0.0 110.066 166.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -64.67 -37.92 89.21 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.78 0.675 . . . . 0.0 110.752 -177.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.07 -64.61 0.82 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.934 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.96 -18.67 64.81 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 120.637 1.562 . . . . 0.0 113.975 -173.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -76.86 -26.65 54.5 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 166.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.22 56.18 0.55 Allowed Pre-proline 0 CA--C 1.562 1.408 0 CA-C-N 119.457 1.026 . . . . 0.0 112.209 -160.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.55 -51.4 0.53 Allowed 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.5 1.467 . . . . 0.0 113.001 -155.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.11 -18.41 63.96 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.236 1.814 . . . . 0.0 113.799 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 ttpt -75.58 -52.9 9.54 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.926 0.89 . . . . 0.0 109.976 164.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -61.82 -44.8 96.12 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.7 pt -134.82 123.37 16.01 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 124.842 1.257 . . . . 0.0 109.656 170.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -66.84 160.32 47.31 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.068 1.845 . . . . 0.0 111.002 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.89 3.86 45.2 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 118.46 -1.189 . . . . 0.0 115.826 175.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.6 m -62.03 120.13 10.24 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.011 1.905 . . . . 0.0 110.951 168.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -87.5 16.69 5.2 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.6 ttt -64.07 94.57 0.11 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.152 0.981 . . . . 0.0 112.172 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.7 mt -73.43 69.52 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.816 1.646 . . . . 0.0 110.2 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -163.38 -37.97 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.551 1.141 . . . . 0.0 113.462 178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.91 -17.68 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 121.235 3.791 . . . . 0.0 121.235 178.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -173.43 157.36 25.96 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 122.246 2.293 . . . . 0.0 113.246 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 14.3 tt -90.27 -57.0 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -162.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.4 mttt 160.93 -84.09 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 131.548 3.939 . . . . 0.0 108.741 167.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -77.13 133.03 39.11 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 127.197 2.199 . . . . 0.0 109.703 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -60.48 -18.25 50.33 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 171.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 95.8 m -78.18 -31.5 49.61 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.152 -1.404 . . . . 0.0 113.875 170.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -60.26 -37.67 81.14 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 121.65 2.023 . . . . 0.0 109.777 165.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.97 -48.28 82.36 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.832 1.653 . . . . 0.0 111.612 173.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -54.5 -53.37 55.21 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.255 0.934 . . . . 0.0 111.328 168.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -61.85 -37.34 84.13 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.224 1.41 . . . . 0.0 111.64 -171.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.32 -43.96 88.4 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 113.066 169.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.6 mm -63.44 -46.92 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.716 0.689 . . . . 0.0 109.87 173.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.31 -47.49 78.61 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.535 0.734 . . . . 0.0 112.247 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -60.46 -57.16 13.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.936 1.294 . . . . 0.0 111.981 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 70.9 mt -74.96 -20.02 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.367 0.985 . . . . 0.0 113.626 -171.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' HE3' ' CD2' ' A' ' 36' ' ' PHE . 3.0 tpmt? -57.68 -43.28 84.94 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.443 1.097 . . . . 0.0 111.465 161.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -75.13 -43.99 49.55 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.676 1.191 . . . . 0.0 112.714 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.45 -8.68 1.27 Allowed 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 117.078 2.251 . . . . 0.0 117.078 -168.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 12.1 t -101.15 9.73 41.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.759 1.224 . . . . 0.0 114.171 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -153.87 -10.12 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.47 2.308 . . . . 0.0 114.434 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--O 1.249 1.077 0 C-N-CA 127.613 2.365 . . . . 0.0 110.369 -173.153 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HEC . . . . . 0.4 ' CGA' ' HE1' ' A' ' 59' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_