data_2li3_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 2li3 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 CA--C 1.548 0.869 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.05 -37.78 79.5 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.558 2.839 . . . . 0.0 115.463 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.58 -31.22 72.14 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.678 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -70.63 -43.53 69.03 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.702 -0.624 . . . . 0.0 110.834 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.6 m -63.06 -59.03 5.36 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.512 0.596 . . . . 0.0 112.243 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.51 -25.06 59.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -172.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.77 64.04 Favored Glycine 0 CA--C 1.537 1.422 0 CA-C-O 118.673 -1.07 . . . . 0.0 115.101 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -132.66 -30.54 1.43 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.2 m -90.36 131.49 36.12 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.725 1.148 . . . . 0.0 111.013 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.91 155.01 39.14 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -165.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.1 -128.2 8.88 Favored Glycine 0 N--CA 1.467 0.705 0 C-N-CA 123.723 0.678 . . . . 0.0 112.429 159.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -137.71 -32.32 0.76 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.463 1.105 . . . . 0.0 113.345 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 68.1 t -70.0 -47.13 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.039 1.336 . . . . 0.0 112.156 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.5 t -63.44 -41.57 98.66 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 121.197 -0.939 . . . . 0.0 111.039 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -56.05 -48.88 75.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.398 0.679 . . . . 0.0 111.436 170.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -65.51 -27.16 68.28 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.103 1.361 . . . . 0.0 113.772 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -69.35 -35.87 76.31 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 120.581 -1.324 . . . . 0.0 110.431 170.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.89 -42.16 58.36 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.566 -0.709 . . . . 0.0 110.626 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.72 -42.25 96.88 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.939 -1.101 . . . . 0.0 112.443 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 mtmm -78.54 -38.45 40.48 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.73 1.88 1.19 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -156.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.25 86.0 m 56.12 41.39 29.57 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.276 2.231 . . . . 0.0 116.355 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -129.83 158.75 38.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.696 1.599 . . . . 0.0 110.457 169.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.7 m -116.18 139.0 50.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 122.341 1.067 . . . . 0.0 111.881 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 tt . . . . . 0 N--CA 1.471 0.613 0 C-N-CA 125.954 1.701 . . . . 0.0 112.844 -165.757 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 64.4 mtm . . . . . 0 CA--C 1.541 0.631 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.292 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.87 -31.93 96.31 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.195 1.93 . . . . 0.0 114.939 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.9 -20.73 62.47 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 114.708 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -85.37 -46.3 11.08 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.968 1.707 . . . . 0.0 110.224 168.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.2 m -59.95 -48.98 79.5 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.652 0.781 . . . . 0.0 112.989 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.15 -10.16 59.5 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 173.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.46 -33.31 39.45 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.84 1.209 . . . . 0.0 113.175 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -98.02 -19.64 17.88 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.1 m -130.73 145.03 51.84 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.435 1.094 . . . . 0.0 112.687 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 mmp_? -99.45 162.22 13.16 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.38 2.272 . . . . 0.0 110.561 169.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 94.99 -145.27 17.64 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-O 118.974 -0.903 . . . . 0.0 112.101 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -140.7 -53.4 0.49 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.106 1.453 . . . . 0.0 114.724 -169.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -70.63 -32.53 49.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.818 0.847 . . . . 0.0 110.436 175.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.0 p -54.12 -54.74 35.46 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 125.97 1.708 . . . . 0.0 111.854 168.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -62.86 -42.14 99.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.628 1.171 . . . . 0.0 111.92 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.69 -28.47 60.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -175.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -65.77 -30.57 71.24 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.159 -1.588 . . . . 0.0 110.197 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.0 t -70.22 -25.58 63.46 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.657 -0.652 . . . . 0.0 111.689 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 mt -75.38 -29.45 59.86 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.7 -32.9 11.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.045 0.938 . . . . 0.0 113.359 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -137.91 10.37 2.85 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.946 1.299 . . . . 0.0 113.755 -162.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.0 m 63.43 7.45 2.98 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.893 2.553 . . . . 0.0 117.893 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.6 mtm105 -131.87 159.97 37.06 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.26 1.424 . . . . 0.0 111.645 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 m -78.54 159.01 28.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 118.257 0.481 . . . . 0.0 110.236 158.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 15.2 tt . . . . . 0 N--CA 1.471 0.624 0 CA-C-O 123.522 1.629 . . . . 0.0 114.653 -156.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 57.7 mtt . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.33 -40.67 65.96 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.36 2.04 . . . . 0.0 113.611 -178.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -69.42 -7.04 34.19 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 174.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -96.68 -43.58 7.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 111.074 166.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 89.6 m -61.37 -30.9 70.82 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.853 -1.155 . . . . 0.0 113.661 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.76 -5.06 54.56 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.54 -27.34 15.16 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.738 1.161 . . . . 0.0 113.477 163.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -88.05 -28.84 21.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 60.5 m -131.43 149.9 52.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.631 1.173 . . . . 0.0 112.873 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -110.81 135.16 51.8 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.311 1.444 . . . . 0.0 110.715 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.34 -145.07 18.63 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.258 1.409 . . . . 0.0 112.713 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -137.99 -44.77 0.52 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.073 1.349 . . . . 0.0 112.911 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.85 -41.0 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.359 1.064 . . . . 0.0 109.978 170.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -59.79 -43.26 94.51 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.88 0.872 . . . . 0.0 112.419 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.16 -27.51 68.07 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.672 1.189 . . . . 0.0 113.756 175.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -78.75 -36.16 43.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.584 1.083 . . . . 0.0 113.28 167.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.05 -43.92 95.04 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.416 -1.428 . . . . 0.0 111.03 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.8 t -58.37 -27.2 63.99 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.558 1.143 . . . . 0.0 113.642 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -62.4 -29.04 70.2 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.908 1.231 . . . . 0.0 113.563 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -111.0 -38.74 4.99 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.131 0.972 . . . . 0.0 113.054 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -92.58 -22.66 19.38 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -171.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.7 m 55.8 21.43 4.74 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.703 1.601 . . . . 0.0 115.091 -173.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -117.09 170.7 8.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.733 2.013 . . . . 0.0 109.485 161.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 m -77.31 174.1 11.16 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 155.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.263 14.4 tt . . . . . 0 CA--C 1.548 0.886 0 O-C-N 120.774 -1.204 . . . . 0.0 113.904 -167.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 60.0 mtm . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.83 -44.24 50.93 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.514 2.809 . . . . 0.0 115.078 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pm0 -74.63 -8.54 56.69 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -91.88 -42.1 10.24 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.734 1.614 . . . . 0.0 110.482 167.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 93.8 m -59.64 -46.32 89.36 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.183 0.993 . . . . 0.0 112.138 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -16.16 61.89 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.07 -27.55 70.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.727 -1.041 . . . . 0.0 113.135 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -104.46 -35.7 7.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.775 1.768 . . . . 0.0 115.775 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.1 m -106.1 146.61 29.96 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.015 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -117.82 137.53 52.7 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.957 1.303 . . . . 0.0 111.504 -171.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.15 -156.53 25.26 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 123.725 0.678 . . . . 0.0 111.946 -161.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -116.49 -46.94 2.75 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 0.0 112.216 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.99 -35.79 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.735 0.814 . . . . 0.0 110.964 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.6 p -66.09 -45.17 82.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.786 1.234 . . . . 0.0 112.752 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -63.63 -43.5 96.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.217 1.007 . . . . 0.0 110.461 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.07 -29.16 70.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.363 1.065 . . . . 0.0 113.437 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -70.87 -37.13 73.05 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.147 -0.971 . . . . 0.0 110.356 175.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 37.2 t -64.42 -34.59 78.53 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.96 -1.088 . . . . 0.0 111.374 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.72 -34.81 73.39 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -119.72 2.1 11.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.196 1.398 . . . . 0.0 114.012 -168.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -145.17 -15.27 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.909 1.283 . . . . 0.0 114.121 -177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.0 m 58.76 37.78 24.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.902 1.281 . . . . 0.0 114.032 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 54.1 mtp85 -141.76 161.52 37.75 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.64 2.376 . . . . 0.0 110.327 171.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -86.11 135.53 33.57 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.807 0.73 . . . . 0.0 110.122 164.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 2.7 tt . . . . . 0 N--CA 1.478 0.938 0 O-C-N 121.261 -0.899 . . . . 0.0 110.165 173.722 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 52.9 mtt . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.71 -35.88 94.0 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.548 2.832 . . . . 0.0 115.755 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -71.95 -36.47 69.89 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.459 0.704 . . . . 0.0 111.944 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.22 -37.2 77.9 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.595 -0.69 . . . . 0.0 111.152 175.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.8 m -61.7 -54.68 39.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.484 0.714 . . . . 0.0 111.603 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.66 60.29 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.67 2.48 39.72 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.803 1.192 . . . . 0.0 115.731 172.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -143.34 -39.15 0.32 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.291 1.545 . . . . 0.0 114.259 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 83.0 m -94.67 141.56 28.47 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.167 0.987 . . . . 0.0 111.222 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -104.11 159.24 15.84 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 112.731 -164.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.05 -135.03 12.83 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.503 1.525 . . . . 0.0 113.711 175.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.1 tttp -132.76 -45.47 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.349 1.46 . . . . 0.0 112.912 174.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -61.82 -39.93 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.038 0.835 . . . . 0.0 112.087 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.1 t -76.61 -38.85 54.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.632 0.773 . . . . 0.0 112.316 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -56.71 -50.66 71.5 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.429 -0.794 . . . . 0.0 111.189 168.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -58.86 -29.25 66.82 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.945 1.698 . . . . 0.0 113.212 173.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -68.33 -43.34 77.76 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.082 -1.011 . . . . 0.0 110.862 174.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.39 -26.58 66.52 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -62.75 -26.68 68.82 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 120.973 -1.079 . . . . 0.0 113.612 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -102.56 -38.34 7.57 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.921 1.289 . . . . 0.0 113.605 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -118.51 -14.0 9.69 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -161.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.8 t 56.66 -11.75 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.588 2.355 . . . . 0.0 116.979 -172.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -75.16 167.27 22.24 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.758 -1.214 . . . . 0.0 109.489 151.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.0 m -98.86 164.02 12.37 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.262 1.025 . . . . 0.0 109.937 159.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 tt . . . . . 0 CA--C 1.551 0.988 0 O-C-N 121.245 -0.909 . . . . 0.0 113.442 -163.189 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 119.124 -0.465 . . . . 0.0 112.161 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -58.54 -35.91 98.05 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.038 1.825 . . . . 0.0 114.496 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -34.49 74.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.287 1.035 . . . . 0.0 113.442 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.14 -48.87 18.98 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.085 1.354 . . . . 0.0 110.756 170.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.1 m -63.87 -39.44 94.21 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.5 53.15 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 174.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.68 -23.96 24.61 Favored Glycine 0 CA--C 1.538 1.528 0 C-N-CA 125.093 1.33 . . . . 0.0 113.456 165.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -81.44 -42.85 19.75 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.504 1.122 . . . . 0.0 112.745 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 91.1 m -135.88 147.81 48.35 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.518 1.127 . . . . 0.0 113.41 -162.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -114.89 147.88 39.35 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.916 1.687 . . . . 0.0 110.415 -169.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.51 -142.44 16.16 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 -164.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.05 -43.01 0.26 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.581 1.191 . . . . 0.0 113.646 -178.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.55 -37.6 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.421 0.688 . . . . 0.0 110.964 172.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.2 p -61.55 -44.65 96.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.943 1.297 . . . . 0.0 112.388 172.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.07 -48.46 78.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.821 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.39 -33.35 71.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.352 1.461 . . . . 0.0 112.904 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.99 -40.52 91.27 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.933 -1.104 . . . . 0.0 110.608 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.2 t -65.38 -35.57 81.36 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.562 0.745 . . . . 0.0 112.835 173.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.12 -36.17 67.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.577 1.08 . . . . 0.0 112.338 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -99.54 -35.87 9.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.988 1.315 . . . . 0.0 113.952 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -126.81 -1.3 6.65 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.415 1.086 . . . . 0.0 113.508 -166.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 58.58 -22.62 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 129.001 2.92 . . . . 0.0 117.84 -175.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -69.88 174.2 5.52 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.012 1.725 . . . . 0.0 109.837 163.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.74 158.55 19.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 111.03 161.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.6 tt . . . . . 0 N--CA 1.473 0.697 0 C-N-CA 125.05 1.34 . . . . 0.0 113.622 -173.243 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -53.03 -42.55 63.78 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.632 2.888 . . . . 0.0 114.886 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.68 -27.91 69.57 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.74 1.216 . . . . 0.0 113.986 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -80.92 -38.03 28.57 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 111.687 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.7 m -54.1 -48.05 71.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.317 0.647 . . . . 0.0 111.145 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.09 -27.91 61.12 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.6 -38.41 78.37 Favored Glycine 0 CA--C 1.536 1.346 0 O-C-N 121.346 -0.847 . . . . 0.0 113.573 173.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -85.06 -28.32 25.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.635 1.174 . . . . 0.0 113.716 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.1 m -126.61 138.96 53.51 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.396 0.998 . . . . 0.0 113.095 -166.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -98.56 137.28 37.45 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.021 1.728 . . . . 0.0 111.998 -170.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.14 -139.51 14.58 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.221 0.915 . . . . 0.0 112.416 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -136.88 -51.72 0.68 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.795 1.638 . . . . 0.0 112.819 -174.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.35 -38.51 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 0.0 110.827 174.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 86.5 p -58.51 -45.6 88.46 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.937 0.895 . . . . 0.0 112.512 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -62.91 -51.09 68.32 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.567 1.547 . . . . 0.0 110.553 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.62 -26.41 68.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.405 1.482 . . . . 0.0 113.801 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -62.99 -42.93 99.98 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.566 -1.334 . . . . 0.0 110.333 170.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -70.58 -33.12 70.73 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 111.629 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.23 -29.7 68.93 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mtmm -112.3 -22.33 10.96 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -130.94 -9.05 3.91 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.959 1.304 . . . . 0.0 113.557 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.284 7.8 t 47.57 40.06 10.87 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.512 1.925 . . . . 0.0 114.405 -172.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -136.03 159.9 40.28 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.615 2.366 . . . . 0.0 109.371 164.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.44 147.9 24.26 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.488 0.585 . . . . 0.0 111.13 163.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.4 tt . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 124.937 1.295 . . . . 0.0 111.52 -167.787 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mtp . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 118.868 -0.587 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.04 -39.35 91.73 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.587 2.192 . . . . 0.0 114.564 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.47 -25.97 64.34 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -71.39 -45.07 63.71 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.121 -0.987 . . . . 0.0 110.705 170.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 81.0 m -58.06 -49.74 75.87 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.403 0.681 . . . . 0.0 112.528 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.71 -22.22 43.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.23 -28.69 72.46 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 118.748 -1.029 . . . . 0.0 113.518 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -103.44 -37.41 7.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.184 1.492 . . . . 0.0 114.371 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.47 144.29 37.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.181 1.355 . . . . 0.0 113.288 -169.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -113.56 137.47 51.52 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.056 1.342 . . . . 0.0 111.089 -165.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.08 -160.97 17.53 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.056 0.836 . . . . 0.0 112.695 -168.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -114.69 -44.13 3.09 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.665 1.586 . . . . 0.0 111.146 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.93 -38.78 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.485 0.714 . . . . 0.0 111.556 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -63.62 -48.01 79.02 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.224 1.409 . . . . 0.0 112.194 176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.32 -46.91 86.61 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.872 1.269 . . . . 0.0 111.333 175.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.44 -23.2 64.58 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.841 0.856 . . . . 0.0 113.023 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.32 -36.26 83.51 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.471 -1.393 . . . . 0.0 109.953 168.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.47 -35.3 46.84 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.461 -0.774 . . . . 0.0 112.088 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -59.16 -40.13 84.62 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.03 0.832 . . . . 0.0 112.02 173.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -93.6 -30.87 14.74 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -139.8 3.94 2.08 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -164.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.281 4.3 t 50.83 19.18 0.59 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 128.025 2.53 . . . . 0.0 117.215 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.1 mmt-85 -111.48 168.46 9.53 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.475 1.51 . . . . 0.0 109.181 163.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -99.07 160.98 13.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.496 0.665 . . . . 0.0 111.122 163.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 14.7 tt . . . . . 0 CA--C 1.54 0.569 0 O-C-N 121.643 -0.66 . . . . 0.0 111.061 -178.724 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 mmt . . . . . 0 CA--C 1.544 0.718 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -55.61 -40.47 85.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.404 2.736 . . . . 0.0 116.32 -171.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -72.11 -29.12 63.77 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.465 1.106 . . . . 0.0 112.527 175.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -81.63 -29.74 33.11 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.056 1.343 . . . . 0.0 112.109 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 92.2 m -57.09 -42.87 81.53 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.079 -1.013 . . . . 0.0 110.546 164.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.03 -2.81 38.96 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -50.73 3.91 Favored Glycine 0 CA--C 1.534 1.235 0 O-C-N 121.314 -0.866 . . . . 0.0 111.61 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.45 -33.29 74.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.721 0.808 . . . . 0.0 113.054 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.4 m -136.87 144.1 43.39 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 0.0 112.641 -165.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -132.11 142.31 49.46 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.306 -0.871 . . . . 0.0 112.42 -168.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.18 -152.71 18.0 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.539 1.542 . . . . 0.0 111.323 -165.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -118.9 -45.41 2.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.932 1.693 . . . . 0.0 112.019 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.14 -36.42 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.185 1.394 . . . . 0.0 111.143 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 64.4 p -57.97 -45.83 86.1 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.118 0.967 . . . . 0.0 111.856 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -66.21 -47.73 72.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.316 1.046 . . . . 0.0 111.821 174.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -57.93 -32.16 67.52 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.185 1.394 . . . . 0.0 114.07 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.03 -34.07 74.63 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.928 174.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 48.1 t -77.56 -29.22 52.05 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.081 -1.012 . . . . 0.0 111.931 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.69 -38.69 91.4 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -98.96 -28.19 13.53 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -173.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -139.94 -1.43 1.59 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -166.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t 44.21 57.93 4.01 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.573 1.549 . . . . 0.0 113.334 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -139.78 167.66 21.6 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.918 2.887 . . . . 0.0 108.696 170.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.4 m -128.33 144.99 51.2 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.395 0.678 . . . . 0.0 111.312 170.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.472 0.631 0 C-N-CA 123.425 0.69 . . . . 0.0 112.826 -165.15 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 59.7 mtt . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 118.637 -0.697 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.6 -38.78 92.45 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.418 2.078 . . . . 0.0 115.079 -169.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -68.68 -30.61 69.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 114.286 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -82.52 -33.42 28.25 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.081 0.855 . . . . 0.0 110.792 173.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.2 m -65.49 -31.47 72.56 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.054 0.942 . . . . 0.0 113.27 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.43 17.0 19.94 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.232 1.413 . . . . 0.0 114.07 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.86 -40.09 85.05 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.767 1.175 . . . . 0.0 113.597 173.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -128.08 7.04 6.0 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.04 1.736 . . . . 0.0 113.637 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.2 m -137.12 139.24 41.07 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.711 1.604 . . . . 0.0 112.012 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -111.79 174.39 5.9 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.577 1.951 . . . . 0.0 111.641 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 -158.49 39.48 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.425 1.012 . . . . 0.0 113.357 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -113.42 -46.37 3.07 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.767 1.627 . . . . 0.0 111.518 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.3 t -60.92 -45.18 98.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 118.795 0.725 . . . . 0.0 111.771 -171.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -80.09 -38.28 32.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.171 0.588 . . . . 0.0 112.121 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -59.12 -48.39 81.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.41 -0.806 . . . . 0.0 112.065 170.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -22.97 61.51 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.48 1.037 . . . . 0.0 113.345 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 29' ' ' ILE . 23.9 t80 -60.97 -43.67 98.46 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.51 -0.744 . . . . 0.0 109.3 168.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -69.06 -31.11 69.64 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.304 -0.873 . . . . 0.0 112.943 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.06 -24.68 67.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 120.029 1.286 . . . . 0.0 113.348 174.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -99.97 -43.7 6.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.837 1.255 . . . . 0.0 113.144 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -114.7 -7.39 12.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.423 1.889 . . . . 0.0 114.203 -161.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m 62.18 9.56 3.25 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.089 2.156 . . . . 0.0 116.473 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.0 mtm105 -119.9 162.33 19.35 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 0.0 110.61 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.8 m -81.72 147.26 29.56 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.345 0.658 . . . . 0.0 109.779 160.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 14.4 tt . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 117.256 2.317 . . . . 0.0 117.256 -151.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -61.34 -35.31 84.63 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 121.68 1.587 . . . . 0.0 115.001 -166.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -77.01 -21.73 54.18 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.421 1.488 . . . . 0.0 113.922 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -81.17 -42.26 21.12 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.229 1.412 . . . . 0.0 109.97 170.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 84.5 m -58.77 -43.35 90.37 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.302 -0.874 . . . . 0.0 112.724 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.96 -12.61 59.97 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.24 -39.28 32.02 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 118.525 0.602 . . . . 0.0 113.136 168.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -94.37 -24.45 17.37 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.9 m -112.59 135.41 53.34 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.026 0.93 . . . . 0.0 112.328 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -104.33 148.53 26.28 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.689 . . . . 0.0 110.508 171.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.67 -160.96 28.09 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.6 1.095 . . . . 0.0 111.929 -162.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -125.8 -45.57 1.75 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.865 1.666 . . . . 0.0 112.206 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.21 -38.45 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 118.985 0.812 . . . . 0.0 110.85 173.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -66.34 -46.43 76.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.68 1.592 . . . . 0.0 112.813 176.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -61.52 -43.6 98.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.375 1.07 . . . . 0.0 110.357 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.04 -28.22 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.703 1.201 . . . . 0.0 113.385 174.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.62 -33.23 72.36 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.071 173.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.76 -33.52 66.39 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.689 -1.257 . . . . 0.0 111.633 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.0 mt -59.23 -38.81 80.89 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.882 0.765 . . . . 0.0 112.533 173.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.7 mtmm -102.02 -23.17 14.13 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -136.93 -5.34 1.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -170.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t 53.06 41.89 32.19 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -134.06 161.45 34.82 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.109 1.764 . . . . 0.0 109.631 163.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.1 m -84.41 141.66 30.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 153.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.278 -173.726 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 118.858 -0.591 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.64 -34.42 92.22 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.367 2.044 . . . . 0.0 115.119 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -72.04 -21.67 61.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.235 1.414 . . . . 0.0 114.399 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 -45.75 17.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.385 0.674 . . . . 0.0 109.886 169.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 70.5 m -56.95 -52.03 66.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.922 0.889 . . . . 0.0 111.92 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.8 -21.06 44.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.39 -22.93 78.57 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.916 171.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -116.32 -10.71 11.34 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.811 1.306 . . . . 0.0 114.498 -176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 m -138.35 134.81 34.68 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.695 1.198 . . . . 0.0 111.171 -173.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -99.91 156.34 17.19 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.255 1.422 . . . . 0.0 112.518 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.86 -153.09 29.33 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.292 1.425 . . . . 0.0 112.236 -173.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -125.87 -32.76 2.78 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.574 1.187 . . . . 0.0 113.633 -178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -66.12 -44.22 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.136 0.88 . . . . 0.0 110.106 175.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 t -61.36 -45.78 92.96 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.239 1.415 . . . . 0.0 111.189 177.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.94 -52.38 56.66 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.478 1.111 . . . . 0.0 113.129 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.98 -24.53 67.75 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -175.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.412 ' HB3' ' H ' ' A' ' 29' ' ' ILE . 12.4 t80 -65.89 -36.67 84.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.459 -0.776 . . . . 0.0 111.606 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -71.34 -28.36 64.02 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.524 1.13 . . . . 0.0 112.007 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.6 mt -66.8 -16.25 64.14 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.89 -12.39 7.54 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -143.13 4.6 1.44 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -171.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t 58.28 -22.24 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 129.435 3.094 . . . . 0.0 118.08 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -77.19 160.56 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.777 -1.202 . . . . 0.0 109.994 165.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.4 m -101.95 103.87 14.53 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.642 0.777 . . . . 0.0 110.645 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.412 ' H ' ' HB3' ' A' ' 21' ' ' TYR 0.401 9.6 tp . . . . . 0 N--CA 1.485 1.32 1 C-N-CA 133.075 4.55 . . . . 0.0 119.463 174.264 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 119.096 -0.478 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -54.92 -35.3 88.99 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.677 2.251 . . . . 0.0 113.961 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.64 -27.29 65.87 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.69 1.132 . . . . 0.0 113.594 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -74.24 -45.64 46.73 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 110.713 168.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.96 -47.68 83.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.244 -0.91 . . . . 0.0 112.963 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.03 -4.25 56.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.699 1.2 . . . . 0.0 113.433 173.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.81 -46.32 7.26 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.875 1.226 . . . . 0.0 111.435 165.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -72.95 -37.39 67.14 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.824 1.25 . . . . 0.0 113.94 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.3 m -139.3 144.78 38.47 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -160.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.93 163.56 13.97 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.161 2.184 . . . . 0.0 112.694 -176.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.49 -144.88 20.83 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.652 1.12 . . . . 0.0 112.085 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -136.18 -37.66 0.71 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.681 1.192 . . . . 0.0 112.371 -172.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.99 -47.57 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.215 1.006 . . . . 0.0 111.455 175.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -72.09 -39.63 68.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.638 0.775 . . . . 0.0 112.191 -174.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -55.6 -47.39 76.57 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.958 0.503 . . . . 0.0 111.045 169.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.31 -29.53 70.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.917 1.287 . . . . 0.0 113.802 174.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -64.2 -40.38 95.96 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.845 -1.159 . . . . 0.0 110.319 175.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.4 t -68.8 -29.95 68.41 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.299 0.639 . . . . 0.0 112.514 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.95 -28.02 69.25 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.087 -1.008 . . . . 0.0 113.458 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -118.62 -29.3 5.45 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -102.76 -15.19 16.35 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.5 1.52 . . . . 0.0 112.626 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.282 8.5 t 51.22 32.12 7.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.121 1.768 . . . . 0.0 114.624 -169.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -131.36 161.32 32.65 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.703 1.601 . . . . 0.0 109.388 168.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 67.6 m -78.47 158.29 28.68 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 161.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.6 tt . . . . . 0 N--CA 1.474 0.767 0 O-C-N 121.039 -1.038 . . . . 0.0 112.418 -174.058 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.6 mmt . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.877 -0.582 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.44 -42.73 45.78 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 122.245 1.963 . . . . 0.0 115.139 -166.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -68.83 -26.48 65.19 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.633 -0.667 . . . . 0.0 112.7 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -88.69 -33.11 17.67 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.416 1.486 . . . . 0.0 112.061 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 94.3 m -57.16 -40.69 77.78 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.116 -0.99 . . . . 0.0 111.325 165.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.22 -1.88 42.5 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 177.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.33 -50.98 2.47 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.292 0.949 . . . . 0.0 112.151 164.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -76.42 -26.58 55.65 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.4 m -118.04 140.79 49.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.552 1.541 . . . . 0.0 111.412 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -114.47 142.68 46.06 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.208 1.403 . . . . 0.0 111.291 -174.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 100.46 -133.7 11.41 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 125.065 1.317 . . . . 0.0 113.462 -171.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.46 -53.1 0.83 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.006 1.322 . . . . 0.0 111.918 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.69 -34.68 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.863 0.865 . . . . 0.0 111.919 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.9 p -63.31 -44.16 95.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.433 1.093 . . . . 0.0 112.469 170.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.94 -43.15 83.95 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.279 1.031 . . . . 0.0 111.062 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.253 0.5 OUTLIER -70.53 -21.58 62.71 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.981 1.264 . . . . 0.0 113.399 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -68.76 -32.71 72.66 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.047 -1.033 . . . . 0.0 111.296 166.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -76.17 -33.05 59.35 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.973 -1.079 . . . . 0.0 111.73 173.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.51 -40.22 96.48 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.258 -0.901 . . . . 0.0 112.681 172.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -91.76 -39.73 11.63 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -128.03 3.72 5.89 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.934 1.294 . . . . 0.0 113.427 -164.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.3 t 63.72 10.96 5.46 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.0 mtm-85 -118.61 169.89 9.42 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.798 1.639 . . . . 0.0 111.4 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 39.6 m -79.52 162.33 25.46 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 157.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.302 16.3 tt . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 123.968 1.842 . . . . 0.0 113.024 -173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.1 mmt . . . . . 0 CA--C 1.543 0.703 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.47 -37.52 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.396 2.73 . . . . 0.0 115.506 -178.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -68.8 -27.29 65.73 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.649 1.58 . . . . 0.0 114.426 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -82.74 -35.63 26.48 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.334 1.054 . . . . 0.0 110.145 173.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.4 m -59.12 -49.62 77.16 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.388 1.075 . . . . 0.0 112.566 174.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.31 5.35 15.01 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 173.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.58 -62.06 1.82 Allowed Glycine 0 CA--C 1.533 1.206 0 O-C-N 121.504 -0.748 . . . . 0.0 111.274 156.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -72.17 -26.78 62.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.055 1.742 . . . . 0.0 115.261 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.0 m -121.82 148.94 44.05 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.868 1.267 . . . . 0.0 112.297 -170.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -121.29 140.32 52.23 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.202 1.801 . . . . 0.0 110.316 -176.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.59 162.74 33.82 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 123.511 0.577 . . . . 0.0 113.159 -170.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -82.47 -39.95 21.8 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.99 1.316 . . . . 0.0 110.689 -164.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.03 -39.12 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 124.861 1.264 . . . . 0.0 111.308 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.5 t -72.15 -43.36 64.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.891 0.769 . . . . 0.0 111.971 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -58.29 -42.69 87.13 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.31 -0.869 . . . . 0.0 111.651 168.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -66.94 -23.86 66.01 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 173.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -69.63 -36.1 75.83 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.18 -1.575 . . . . 0.0 110.654 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.8 t -71.34 -33.1 69.31 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.806 -0.559 . . . . 0.0 111.713 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.25 -39.09 78.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.04 0.837 . . . . 0.0 112.521 174.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -105.45 -26.28 12.0 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -168.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -135.17 5.47 3.28 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.225 1.41 . . . . 0.0 113.092 -171.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.8 m 54.64 28.08 9.49 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 175.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -132.27 166.49 21.77 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.309 1.844 . . . . 0.0 110.88 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 m -70.18 163.62 25.97 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 151.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 11.8 tt . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -169.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 76.4 mtm . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.88 -36.53 98.17 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.033 2.489 . . . . 0.0 113.61 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.18 -27.74 68.91 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.912 1.285 . . . . 0.0 114.115 177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -74.8 -48.74 23.73 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.174 0.99 . . . . 0.0 110.59 166.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 72.6 m -57.69 -43.07 84.86 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.41 -11.35 59.94 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 176.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.55 -41.7 10.99 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.577 1.084 . . . . 0.0 112.65 166.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -76.65 -26.72 55.18 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 118.576 1.188 . . . . 0.0 113.327 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.14 145.95 34.78 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -165.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -118.46 148.81 42.2 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.528 1.931 . . . . 0.0 112.414 -171.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 101.52 -138.46 13.89 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.654 1.121 . . . . 0.0 112.466 -170.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -132.36 -51.55 0.94 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.487 1.915 . . . . 0.0 112.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.9 t -70.73 -31.8 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.599 0.76 . . . . 0.0 111.239 -173.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.4 p -60.34 -53.23 60.08 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.431 1.492 . . . . 0.0 111.877 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -58.39 -47.95 82.21 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.359 1.464 . . . . 0.0 111.587 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.29 -28.38 69.68 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.113 1.765 . . . . 0.0 113.67 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -71.06 -39.05 72.47 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.096 -1.003 . . . . 0.0 110.327 172.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.28 -33.09 74.57 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.347 -0.845 . . . . 0.0 111.803 176.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.1 mt -61.09 -28.74 69.3 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.982 -1.074 . . . . 0.0 113.283 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -103.41 -20.17 14.16 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -148.09 3.15 0.69 Allowed 'General case' 0 CA--C 1.555 1.136 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 -170.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.4 m 56.66 -13.38 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -76.34 172.14 13.39 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.099 1.318 . . . . 0.0 109.887 159.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.6 m -110.72 159.72 17.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.821 0.848 . . . . 0.0 111.252 161.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 16.4 tt . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -170.125 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 50.0 mtt . . . . . 0 CA--C 1.546 0.802 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.206 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.61 -37.24 95.45 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.754 2.303 . . . . 0.0 113.869 -177.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.5 -8.05 55.73 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -84.64 -46.02 11.92 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 163.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.3 m -56.26 -59.65 4.64 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.318 1.047 . . . . 0.0 112.513 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.06 -0.09 26.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.87 -26.02 54.54 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.774 1.178 . . . . 0.0 114.011 169.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -125.57 -22.1 4.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.6 134.48 53.14 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.718 1.145 . . . . 0.0 111.054 -174.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -115.24 143.59 45.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.411 1.484 . . . . 0.0 110.535 -164.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.03 -141.93 15.45 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 124.214 0.912 . . . . 0.0 112.876 -173.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -127.73 -45.87 1.44 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.959 1.304 . . . . 0.0 112.617 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -63.92 -39.07 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 119.374 0.988 . . . . 0.0 112.253 -177.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.9 p -63.8 -48.09 78.25 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.592 1.157 . . . . 0.0 111.983 175.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.56 -52.34 65.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.066 1.346 . . . . 0.0 111.486 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -56.96 -34.32 67.93 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.285 1.834 . . . . 0.0 113.189 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -67.36 -36.81 82.14 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 121.271 -0.893 . . . . 0.0 110.536 173.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.9 t -76.83 -31.55 56.98 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.011 -1.056 . . . . 0.0 112.561 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.63 -34.28 75.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.378 0.99 . . . . 0.0 111.816 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -87.23 -44.43 11.46 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 174.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -118.16 -5.59 10.91 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.815 1.246 . . . . 0.0 114.065 -160.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.0 m 60.84 20.9 11.09 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.884 2.073 . . . . 0.0 115.881 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -137.33 170.49 15.99 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 129.267 3.027 . . . . 0.0 108.018 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -107.38 142.42 37.23 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.87 1.668 . . . . 0.0 112.11 173.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 125.374 1.47 . . . . 0.0 113.212 -169.15 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 39.2 mtt . . . . . 0 CA--C 1.545 0.774 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.06 -34.25 98.86 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.805 1.67 . . . . 0.0 115.442 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -63.58 -41.17 98.4 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.009 1.277 . . . . 0.0 112.91 176.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -63.49 -46.92 83.92 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.973 0.909 . . . . 0.0 110.47 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 85.0 m -67.14 -38.13 85.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.996 0.918 . . . . 0.0 113.243 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.0 -7.13 57.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.34 -44.42 9.62 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 123.65 0.643 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -78.7 -33.97 46.43 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.2 m -113.98 158.44 21.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.914 1.285 . . . . 0.0 112.768 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 -119.83 147.3 44.83 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.284 1.434 . . . . 0.0 110.524 170.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.95 -155.79 20.04 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.89 1.233 . . . . 0.0 111.629 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -129.13 -42.86 1.34 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.431 1.115 . . . . 0.0 112.656 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -64.82 -36.6 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.297 0.953 . . . . 0.0 110.906 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.7 p -59.29 -43.31 92.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.08 0.952 . . . . 0.0 112.49 172.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -65.97 -45.62 81.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.044 1.338 . . . . 0.0 111.006 175.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.04 -33.37 75.58 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.799 1.24 . . . . 0.0 113.66 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -67.93 -38.93 83.49 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.639 -1.288 . . . . 0.0 110.513 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -65.64 -31.48 72.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.404 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.4 mt -57.69 -32.16 67.07 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.716 1.144 . . . . 0.0 112.963 177.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -104.22 -33.13 8.81 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.167 1.787 . . . . 0.0 114.367 -175.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -123.76 -3.47 8.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.639 1.176 . . . . 0.0 113.552 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 79.8 m 57.13 13.77 1.75 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -175.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -115.77 160.24 20.37 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.093 1.757 . . . . 0.0 110.89 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 m -74.9 155.56 37.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 159.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 CA--C 1.542 0.647 0 O-C-N 121.364 -0.835 . . . . 0.0 111.898 -176.995 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 44.0 mtt . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.11 -34.64 79.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.389 1.393 . . . . 0.0 114.5 -170.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -78.26 -14.03 59.61 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -83.9 -42.24 16.56 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.127 0.971 . . . . 0.0 110.513 165.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.5 m -62.57 -41.57 99.01 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.38 -0.825 . . . . 0.0 112.488 177.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.29 -5.45 49.48 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 170.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.18 -31.6 27.98 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.529 1.061 . . . . 0.0 113.178 167.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -106.9 -19.66 13.57 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.3 137.29 54.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.82 1.248 . . . . 0.0 111.049 -175.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -106.18 146.44 30.26 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.859 1.264 . . . . 0.0 110.661 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.0 -143.95 16.98 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 123.954 0.787 . . . . 0.0 112.249 -168.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -139.42 -43.84 0.45 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.612 1.165 . . . . 0.0 113.223 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.2 t -64.11 -37.43 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.657 0.783 . . . . 0.0 110.145 174.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 91.6 p -61.78 -45.43 93.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.976 1.31 . . . . 0.0 112.989 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.95 -48.22 81.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.396 1.479 . . . . 0.0 110.816 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.99 -30.16 70.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.997 1.319 . . . . 0.0 113.549 175.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -69.96 -41.39 74.58 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.088 -1.007 . . . . 0.0 110.199 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.1 t -62.97 -35.35 79.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.295 -0.86 . . . . 0.0 112.606 176.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.79 -38.81 67.76 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.587 0.708 . . . . 0.0 111.968 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -91.51 -53.55 4.27 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.923 1.289 . . . . 0.0 111.624 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -103.86 -1.96 26.99 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.741 1.616 . . . . 0.0 114.574 -162.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.5 m 56.28 30.21 16.3 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.119 1.368 . . . . 0.0 114.486 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -139.2 160.1 40.6 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.061 2.144 . . . . 0.0 111.002 176.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -82.87 137.17 34.36 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 162.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 tt . . . . . 0 N--CA 1.472 0.664 0 O-C-N 122.005 -0.435 . . . . 0.0 111.663 -176.451 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 28.7 mtt . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -56.34 -39.13 93.32 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.609 2.206 . . . . 0.0 113.999 173.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -35.48 79.39 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.118 -0.989 . . . . 0.0 112.648 174.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -76.7 -31.84 57.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.995 0.918 . . . . 0.0 112.08 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.2 m -60.13 -43.87 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.979 -1.076 . . . . 0.0 112.145 168.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.58 -19.47 45.52 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.62 -48.03 77.24 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 121.167 -0.958 . . . . 0.0 111.546 165.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -75.08 -55.55 5.62 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.504 1.122 . . . . 0.0 113.609 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.85 146.41 25.98 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.013 0.925 . . . . 0.0 112.434 -164.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmt-85 -106.41 124.81 50.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.697 1.199 . . . . 0.0 111.795 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.15 -157.61 15.46 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.765 1.174 . . . . 0.0 114.548 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -105.48 -53.41 2.66 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.568 1.547 . . . . 0.0 110.779 -178.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.0 t -63.31 -37.28 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.538 0.735 . . . . 0.0 111.498 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.3 p -69.74 -45.32 68.4 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.363 1.065 . . . . 0.0 112.822 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.47 -49.64 76.77 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.536 1.135 . . . . 0.0 110.857 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -61.16 -28.09 68.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.061 1.344 . . . . 0.0 113.758 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.78 -40.67 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.92 -1.113 . . . . 0.0 110.918 172.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.0 t -67.22 -28.38 68.02 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.426 -0.796 . . . . 0.0 112.211 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.58 -16.67 63.93 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.35 -49.42 2.96 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.873 1.269 . . . . 0.0 113.874 173.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -101.03 -6.45 24.4 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.542 1.537 . . . . 0.0 113.816 -169.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.7 m 58.87 23.39 11.3 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.9 mtm105 -128.84 163.81 24.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.146 2.178 . . . . 0.0 110.431 170.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.3 m -71.91 153.32 41.93 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.762 -0.586 . . . . 0.0 109.927 157.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.3 tt . . . . . 0 N--CA 1.473 0.72 0 C-N-CA 124.492 1.117 . . . . 0.0 113.096 -169.654 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.154 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m -130.32 141.29 50.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.445 1.498 . . . . 0.0 112.25 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 104.2 4.19 44.39 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 126.101 1.81 . . . . 0.0 115.01 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.2 p -169.22 131.95 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.159 1.784 . . . . 0.0 110.11 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mmm -82.76 147.93 56.4 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 123.657 0.783 . . . . 0.0 112.063 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.05 -37.78 79.5 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.558 2.839 . . . . 0.0 115.463 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.58 -31.22 72.14 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.678 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -70.63 -43.53 69.03 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.702 -0.624 . . . . 0.0 110.834 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.6 m -63.06 -59.03 5.36 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.512 0.596 . . . . 0.0 112.243 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.51 -25.06 59.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -172.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.77 64.04 Favored Glycine 0 CA--C 1.537 1.422 0 CA-C-O 118.673 -1.07 . . . . 0.0 115.101 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -132.66 -30.54 1.43 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.2 m -90.36 131.49 36.12 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.725 1.148 . . . . 0.0 111.013 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.91 155.01 39.14 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -165.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.1 -128.2 8.88 Favored Glycine 0 N--CA 1.467 0.705 0 C-N-CA 123.723 0.678 . . . . 0.0 112.429 159.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -137.71 -32.32 0.76 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.463 1.105 . . . . 0.0 113.345 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 68.1 t -70.0 -47.13 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.039 1.336 . . . . 0.0 112.156 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.5 t -63.44 -41.57 98.66 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 121.197 -0.939 . . . . 0.0 111.039 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -56.05 -48.88 75.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.398 0.679 . . . . 0.0 111.436 170.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -65.51 -27.16 68.28 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.103 1.361 . . . . 0.0 113.772 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -69.35 -35.87 76.31 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 120.581 -1.324 . . . . 0.0 110.431 170.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.89 -42.16 58.36 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.566 -0.709 . . . . 0.0 110.626 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.72 -42.25 96.88 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.939 -1.101 . . . . 0.0 112.443 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 mtmm -78.54 -38.45 40.48 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.73 1.88 1.19 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -156.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.25 86.0 m 56.12 41.39 29.57 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.276 2.231 . . . . 0.0 116.355 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -129.83 158.75 38.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.696 1.599 . . . . 0.0 110.457 169.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.7 m -116.18 139.0 50.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 122.341 1.067 . . . . 0.0 111.881 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 tt -80.63 157.84 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 125.954 1.701 . . . . 0.0 112.844 -165.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.179 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.1 p -129.75 10.44 5.56 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.382 1.473 . . . . 0.0 114.611 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.81 162.06 10.7 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.105 1.336 . . . . 0.0 113.263 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 12.9 m -78.15 54.01 1.29 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.863 1.665 . . . . 0.0 112.427 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 64.4 mtm -82.65 145.25 50.4 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.726 1.61 . . . . 0.0 111.292 -174.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.87 -31.93 96.31 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.195 1.93 . . . . 0.0 114.939 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.9 -20.73 62.47 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 114.708 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -85.37 -46.3 11.08 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.968 1.707 . . . . 0.0 110.224 168.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.2 m -59.95 -48.98 79.5 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.652 0.781 . . . . 0.0 112.989 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.15 -10.16 59.5 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 173.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.46 -33.31 39.45 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.84 1.209 . . . . 0.0 113.175 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -98.02 -19.64 17.88 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.1 m -130.73 145.03 51.84 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.435 1.094 . . . . 0.0 112.687 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 mmp_? -99.45 162.22 13.16 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.38 2.272 . . . . 0.0 110.561 169.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 94.99 -145.27 17.64 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-O 118.974 -0.903 . . . . 0.0 112.101 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -140.7 -53.4 0.49 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.106 1.453 . . . . 0.0 114.724 -169.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -70.63 -32.53 49.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.818 0.847 . . . . 0.0 110.436 175.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.0 p -54.12 -54.74 35.46 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 125.97 1.708 . . . . 0.0 111.854 168.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -62.86 -42.14 99.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.628 1.171 . . . . 0.0 111.92 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.69 -28.47 60.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -175.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -65.77 -30.57 71.24 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.159 -1.588 . . . . 0.0 110.197 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.0 t -70.22 -25.58 63.46 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.657 -0.652 . . . . 0.0 111.689 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 mt -75.38 -29.45 59.86 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.7 -32.9 11.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.045 0.938 . . . . 0.0 113.359 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -137.91 10.37 2.85 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.946 1.299 . . . . 0.0 113.755 -162.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.0 m 63.43 7.45 2.98 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.893 2.553 . . . . 0.0 117.893 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.6 mtm105 -131.87 159.97 37.06 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.26 1.424 . . . . 0.0 111.645 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 m -78.54 159.01 28.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 118.257 0.481 . . . . 0.0 110.236 158.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 15.2 tt -86.46 60.53 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 123.522 1.629 . . . . 0.0 114.653 -156.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 128.307 2.643 . . . . 0.0 112.516 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.1 t -54.66 130.92 42.1 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.621 1.168 . . . . 0.0 112.883 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.15 3.59 72.66 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 164.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.9 m -134.04 62.42 1.65 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.52 1.528 . . . . 0.0 111.371 -169.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.76 154.66 88.3 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.052 1.341 . . . . 0.0 112.854 -178.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.33 -40.67 65.96 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.36 2.04 . . . . 0.0 113.611 -178.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -69.42 -7.04 34.19 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 174.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -96.68 -43.58 7.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 111.074 166.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 89.6 m -61.37 -30.9 70.82 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.853 -1.155 . . . . 0.0 113.661 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.76 -5.06 54.56 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.54 -27.34 15.16 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.738 1.161 . . . . 0.0 113.477 163.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -88.05 -28.84 21.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 60.5 m -131.43 149.9 52.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.631 1.173 . . . . 0.0 112.873 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -110.81 135.16 51.8 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.311 1.444 . . . . 0.0 110.715 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.34 -145.07 18.63 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.258 1.409 . . . . 0.0 112.713 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -137.99 -44.77 0.52 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.073 1.349 . . . . 0.0 112.911 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.85 -41.0 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.359 1.064 . . . . 0.0 109.978 170.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -59.79 -43.26 94.51 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.88 0.872 . . . . 0.0 112.419 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.16 -27.51 68.07 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.672 1.189 . . . . 0.0 113.756 175.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -78.75 -36.16 43.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.584 1.083 . . . . 0.0 113.28 167.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.05 -43.92 95.04 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.416 -1.428 . . . . 0.0 111.03 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.8 t -58.37 -27.2 63.99 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.558 1.143 . . . . 0.0 113.642 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -62.4 -29.04 70.2 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.908 1.231 . . . . 0.0 113.563 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -111.0 -38.74 4.99 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.131 0.972 . . . . 0.0 113.054 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -92.58 -22.66 19.38 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -171.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.7 m 55.8 21.43 4.74 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.703 1.601 . . . . 0.0 115.091 -173.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -117.09 170.7 8.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.733 2.013 . . . . 0.0 109.485 161.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 m -77.31 174.1 11.16 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 155.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.263 14.4 tt -65.34 96.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 O-C-N 120.774 -1.204 . . . . 0.0 113.904 -167.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 128.046 2.538 . . . . 0.0 111.65 172.336 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.117 0 N-CA-C 110.181 -1.167 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.9 m -123.91 12.96 9.13 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.717 1.207 . . . . 0.0 113.73 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.16 146.83 28.03 Favored Glycine 0 CA--C 1.534 1.245 0 O-C-N 121.408 -0.808 . . . . 0.0 112.591 173.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 p -137.99 31.83 2.44 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -171.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 60.0 mtm -70.91 147.44 94.05 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.457 0.703 . . . . 0.0 110.429 159.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.83 -44.24 50.93 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.514 2.809 . . . . 0.0 115.078 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pm0 -74.63 -8.54 56.69 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -91.88 -42.1 10.24 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.734 1.614 . . . . 0.0 110.482 167.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 93.8 m -59.64 -46.32 89.36 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.183 0.993 . . . . 0.0 112.138 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -16.16 61.89 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.07 -27.55 70.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.727 -1.041 . . . . 0.0 113.135 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -104.46 -35.7 7.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.775 1.768 . . . . 0.0 115.775 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.1 m -106.1 146.61 29.96 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.015 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -117.82 137.53 52.7 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.957 1.303 . . . . 0.0 111.504 -171.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.15 -156.53 25.26 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 123.725 0.678 . . . . 0.0 111.946 -161.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -116.49 -46.94 2.75 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 0.0 112.216 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.99 -35.79 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.735 0.814 . . . . 0.0 110.964 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.6 p -66.09 -45.17 82.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.786 1.234 . . . . 0.0 112.752 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -63.63 -43.5 96.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.217 1.007 . . . . 0.0 110.461 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.07 -29.16 70.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.363 1.065 . . . . 0.0 113.437 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -70.87 -37.13 73.05 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.147 -0.971 . . . . 0.0 110.356 175.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 37.2 t -64.42 -34.59 78.53 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.96 -1.088 . . . . 0.0 111.374 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.72 -34.81 73.39 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -119.72 2.1 11.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.196 1.398 . . . . 0.0 114.012 -168.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -145.17 -15.27 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.909 1.283 . . . . 0.0 114.121 -177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.0 m 58.76 37.78 24.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.902 1.281 . . . . 0.0 114.032 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 54.1 mtp85 -141.76 161.52 37.75 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.64 2.376 . . . . 0.0 110.327 171.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -86.11 135.53 33.57 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.807 0.73 . . . . 0.0 110.122 164.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 2.7 tt -64.77 131.86 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 O-C-N 121.261 -0.899 . . . . 0.0 110.165 173.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.591 0.756 . . . . 0.0 112.504 -174.659 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.975 0 CA-C-O 119.073 -0.849 . . . . 0.0 111.381 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -131.89 165.76 23.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.998 2.119 . . . . 0.0 110.845 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.07 -146.22 25.11 Favored Glycine 0 N--CA 1.47 0.946 0 O-C-N 121.431 -0.793 . . . . 0.0 111.52 -169.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 78.7 m -74.95 48.45 0.39 Allowed 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.654 -1.498 . . . . 0.0 113.77 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 52.9 mtt -110.88 150.34 41.7 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.418 1.887 . . . . 0.0 113.089 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.71 -35.88 94.0 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.548 2.832 . . . . 0.0 115.755 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -71.95 -36.47 69.89 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.459 0.704 . . . . 0.0 111.944 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.22 -37.2 77.9 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.595 -0.69 . . . . 0.0 111.152 175.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.8 m -61.7 -54.68 39.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.484 0.714 . . . . 0.0 111.603 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.66 60.29 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.67 2.48 39.72 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.803 1.192 . . . . 0.0 115.731 172.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -143.34 -39.15 0.32 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.291 1.545 . . . . 0.0 114.259 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 83.0 m -94.67 141.56 28.47 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.167 0.987 . . . . 0.0 111.222 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -104.11 159.24 15.84 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 112.731 -164.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.05 -135.03 12.83 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.503 1.525 . . . . 0.0 113.711 175.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.1 tttp -132.76 -45.47 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.349 1.46 . . . . 0.0 112.912 174.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -61.82 -39.93 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.038 0.835 . . . . 0.0 112.087 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.1 t -76.61 -38.85 54.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.632 0.773 . . . . 0.0 112.316 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -56.71 -50.66 71.5 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.429 -0.794 . . . . 0.0 111.189 168.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -58.86 -29.25 66.82 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.945 1.698 . . . . 0.0 113.212 173.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -68.33 -43.34 77.76 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.082 -1.011 . . . . 0.0 110.862 174.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.39 -26.58 66.52 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -62.75 -26.68 68.82 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 120.973 -1.079 . . . . 0.0 113.612 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -102.56 -38.34 7.57 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.921 1.289 . . . . 0.0 113.605 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -118.51 -14.0 9.69 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -161.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.8 t 56.66 -11.75 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.588 2.355 . . . . 0.0 116.979 -172.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -75.16 167.27 22.24 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.758 -1.214 . . . . 0.0 109.489 151.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.0 m -98.86 164.02 12.37 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.262 1.025 . . . . 0.0 109.937 159.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 tt -70.39 108.95 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 O-C-N 121.245 -0.909 . . . . 0.0 113.442 -163.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 125.528 1.531 . . . . 0.0 114.193 -164.81 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.268 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -73.53 63.88 0.84 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.411 1.884 . . . . 0.0 111.609 173.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.87 -176.13 50.64 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 123.745 0.688 . . . . 0.0 111.911 -152.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 12.5 m 53.49 79.37 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.127 1.771 . . . . 0.0 110.856 -171.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 21.2 mmt -94.72 159.22 33.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.448 1.499 . . . . 0.0 112.161 -172.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -58.54 -35.91 98.05 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.038 1.825 . . . . 0.0 114.496 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -34.49 74.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.287 1.035 . . . . 0.0 113.442 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.14 -48.87 18.98 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.085 1.354 . . . . 0.0 110.756 170.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.1 m -63.87 -39.44 94.21 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.5 53.15 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 174.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.68 -23.96 24.61 Favored Glycine 0 CA--C 1.538 1.528 0 C-N-CA 125.093 1.33 . . . . 0.0 113.456 165.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -81.44 -42.85 19.75 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.504 1.122 . . . . 0.0 112.745 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 91.1 m -135.88 147.81 48.35 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.518 1.127 . . . . 0.0 113.41 -162.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -114.89 147.88 39.35 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.916 1.687 . . . . 0.0 110.415 -169.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.51 -142.44 16.16 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 -164.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.05 -43.01 0.26 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.581 1.191 . . . . 0.0 113.646 -178.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.55 -37.6 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.421 0.688 . . . . 0.0 110.964 172.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.2 p -61.55 -44.65 96.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.943 1.297 . . . . 0.0 112.388 172.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.07 -48.46 78.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.821 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.39 -33.35 71.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.352 1.461 . . . . 0.0 112.904 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.99 -40.52 91.27 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.933 -1.104 . . . . 0.0 110.608 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.2 t -65.38 -35.57 81.36 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.562 0.745 . . . . 0.0 112.835 173.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.12 -36.17 67.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.577 1.08 . . . . 0.0 112.338 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -99.54 -35.87 9.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.988 1.315 . . . . 0.0 113.952 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -126.81 -1.3 6.65 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.415 1.086 . . . . 0.0 113.508 -166.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 58.58 -22.62 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 129.001 2.92 . . . . 0.0 117.84 -175.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -69.88 174.2 5.52 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.012 1.725 . . . . 0.0 109.837 163.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.74 158.55 19.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 111.03 161.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.6 tt -58.32 146.62 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.05 1.34 . . . . 0.0 113.622 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 . . . . . 0 C--O 1.248 1.003 0 C-N-CA 126.091 1.756 . . . . 0.0 111.211 174.683 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -129.9 162.55 28.32 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.202 1.401 . . . . 0.0 112.777 -170.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.95 -127.88 9.24 Favored Glycine 0 N--CA 1.474 1.192 0 O-C-N 121.43 -0.793 . . . . 0.0 114.05 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.7 m -85.34 21.94 1.62 Allowed 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.704 1.252 . . . . 0.0 113.613 175.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 87.6 mtp -79.01 136.05 58.16 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 124.061 0.944 . . . . 0.0 110.749 176.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -53.03 -42.55 63.78 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.632 2.888 . . . . 0.0 114.886 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.68 -27.91 69.57 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.74 1.216 . . . . 0.0 113.986 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -80.92 -38.03 28.57 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 111.687 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.7 m -54.1 -48.05 71.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.317 0.647 . . . . 0.0 111.145 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.09 -27.91 61.12 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.6 -38.41 78.37 Favored Glycine 0 CA--C 1.536 1.346 0 O-C-N 121.346 -0.847 . . . . 0.0 113.573 173.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -85.06 -28.32 25.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.635 1.174 . . . . 0.0 113.716 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.1 m -126.61 138.96 53.51 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.396 0.998 . . . . 0.0 113.095 -166.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -98.56 137.28 37.45 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.021 1.728 . . . . 0.0 111.998 -170.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.14 -139.51 14.58 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.221 0.915 . . . . 0.0 112.416 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -136.88 -51.72 0.68 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.795 1.638 . . . . 0.0 112.819 -174.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.35 -38.51 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 0.0 110.827 174.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 86.5 p -58.51 -45.6 88.46 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.937 0.895 . . . . 0.0 112.512 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -62.91 -51.09 68.32 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.567 1.547 . . . . 0.0 110.553 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.62 -26.41 68.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.405 1.482 . . . . 0.0 113.801 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -62.99 -42.93 99.98 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.566 -1.334 . . . . 0.0 110.333 170.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -70.58 -33.12 70.73 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 111.629 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.23 -29.7 68.93 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mtmm -112.3 -22.33 10.96 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -130.94 -9.05 3.91 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.959 1.304 . . . . 0.0 113.557 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.284 7.8 t 47.57 40.06 10.87 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.512 1.925 . . . . 0.0 114.405 -172.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -136.03 159.9 40.28 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.615 2.366 . . . . 0.0 109.371 164.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.44 147.9 24.26 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.488 0.585 . . . . 0.0 111.13 163.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.4 tt -69.36 120.95 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 124.937 1.295 . . . . 0.0 111.52 -167.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 C--O 1.253 1.259 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -173.041 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.997 0 CA-C-O 119.818 -0.434 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.1 p -149.77 -12.42 0.28 Allowed 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 164.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.98 -179.21 38.82 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.631 1.586 . . . . 0.0 112.776 169.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 56.5 m -78.46 63.17 3.25 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.269 1.027 . . . . 0.0 112.785 -173.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mtp -96.3 145.02 28.84 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 126.734 2.013 . . . . 0.0 111.556 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.04 -39.35 91.73 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.587 2.192 . . . . 0.0 114.564 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.47 -25.97 64.34 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -71.39 -45.07 63.71 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.121 -0.987 . . . . 0.0 110.705 170.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 81.0 m -58.06 -49.74 75.87 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.403 0.681 . . . . 0.0 112.528 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.71 -22.22 43.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.23 -28.69 72.46 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 118.748 -1.029 . . . . 0.0 113.518 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -103.44 -37.41 7.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.184 1.492 . . . . 0.0 114.371 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.47 144.29 37.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.181 1.355 . . . . 0.0 113.288 -169.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -113.56 137.47 51.52 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.056 1.342 . . . . 0.0 111.089 -165.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.08 -160.97 17.53 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.056 0.836 . . . . 0.0 112.695 -168.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -114.69 -44.13 3.09 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.665 1.586 . . . . 0.0 111.146 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.93 -38.78 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.485 0.714 . . . . 0.0 111.556 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -63.62 -48.01 79.02 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.224 1.409 . . . . 0.0 112.194 176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.32 -46.91 86.61 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.872 1.269 . . . . 0.0 111.333 175.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.44 -23.2 64.58 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.841 0.856 . . . . 0.0 113.023 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.32 -36.26 83.51 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.471 -1.393 . . . . 0.0 109.953 168.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.47 -35.3 46.84 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.461 -0.774 . . . . 0.0 112.088 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -59.16 -40.13 84.62 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.03 0.832 . . . . 0.0 112.02 173.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -93.6 -30.87 14.74 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -139.8 3.94 2.08 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -164.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.281 4.3 t 50.83 19.18 0.59 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 128.025 2.53 . . . . 0.0 117.215 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.1 mmt-85 -111.48 168.46 9.53 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.475 1.51 . . . . 0.0 109.181 163.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -99.07 160.98 13.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.496 0.665 . . . . 0.0 111.122 163.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 14.7 tt -69.68 128.92 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.643 -0.66 . . . . 0.0 111.061 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.3 mtm180 . . . . . 0 C--O 1.252 1.23 0 C-N-CA 127.8 2.44 . . . . 0.0 109.355 -179.489 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.099 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -136.02 19.34 3.23 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.969 1.307 . . . . 0.0 114.317 177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.08 145.41 4.53 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.343 1.449 . . . . 0.0 112.14 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 79.5 m -118.3 8.13 12.17 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -174.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 mmt -70.06 143.41 91.47 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.361 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -55.61 -40.47 85.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.404 2.736 . . . . 0.0 116.32 -171.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -72.11 -29.12 63.77 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.465 1.106 . . . . 0.0 112.527 175.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -81.63 -29.74 33.11 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.056 1.343 . . . . 0.0 112.109 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 92.2 m -57.09 -42.87 81.53 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.079 -1.013 . . . . 0.0 110.546 164.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.03 -2.81 38.96 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -50.73 3.91 Favored Glycine 0 CA--C 1.534 1.235 0 O-C-N 121.314 -0.866 . . . . 0.0 111.61 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.45 -33.29 74.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.721 0.808 . . . . 0.0 113.054 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.4 m -136.87 144.1 43.39 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 0.0 112.641 -165.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -132.11 142.31 49.46 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.306 -0.871 . . . . 0.0 112.42 -168.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.18 -152.71 18.0 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.539 1.542 . . . . 0.0 111.323 -165.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -118.9 -45.41 2.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.932 1.693 . . . . 0.0 112.019 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.14 -36.42 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.185 1.394 . . . . 0.0 111.143 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 64.4 p -57.97 -45.83 86.1 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.118 0.967 . . . . 0.0 111.856 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -66.21 -47.73 72.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.316 1.046 . . . . 0.0 111.821 174.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -57.93 -32.16 67.52 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.185 1.394 . . . . 0.0 114.07 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.03 -34.07 74.63 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.928 174.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 48.1 t -77.56 -29.22 52.05 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.081 -1.012 . . . . 0.0 111.931 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.69 -38.69 91.4 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -98.96 -28.19 13.53 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -173.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -139.94 -1.43 1.59 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -166.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t 44.21 57.93 4.01 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.573 1.549 . . . . 0.0 113.334 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -139.78 167.66 21.6 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.918 2.887 . . . . 0.0 108.696 170.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.4 m -128.33 144.99 51.2 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.395 0.678 . . . . 0.0 111.312 170.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -83.7 133.92 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.425 0.69 . . . . 0.0 112.826 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--O 1.248 1.0 0 C-N-CA 127.674 2.389 . . . . 0.0 111.731 178.115 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.954 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -142.81 171.79 13.57 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 0.0 111.928 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.77 -122.01 6.92 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 121.493 -0.754 . . . . 0.0 113.447 172.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 30.49 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 126.767 2.027 . . . . 0.0 116.309 -174.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 59.7 mtt -112.61 144.13 30.34 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 127.947 2.499 . . . . 0.0 111.922 -176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.6 -38.78 92.45 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.418 2.078 . . . . 0.0 115.079 -169.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -68.68 -30.61 69.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 114.286 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -82.52 -33.42 28.25 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.081 0.855 . . . . 0.0 110.792 173.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.2 m -65.49 -31.47 72.56 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.054 0.942 . . . . 0.0 113.27 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.43 17.0 19.94 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.232 1.413 . . . . 0.0 114.07 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.86 -40.09 85.05 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.767 1.175 . . . . 0.0 113.597 173.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -128.08 7.04 6.0 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.04 1.736 . . . . 0.0 113.637 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.2 m -137.12 139.24 41.07 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.711 1.604 . . . . 0.0 112.012 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -111.79 174.39 5.9 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.577 1.951 . . . . 0.0 111.641 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 -158.49 39.48 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.425 1.012 . . . . 0.0 113.357 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -113.42 -46.37 3.07 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.767 1.627 . . . . 0.0 111.518 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.3 t -60.92 -45.18 98.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 118.795 0.725 . . . . 0.0 111.771 -171.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -80.09 -38.28 32.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.171 0.588 . . . . 0.0 112.121 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -59.12 -48.39 81.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.41 -0.806 . . . . 0.0 112.065 170.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -22.97 61.51 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.48 1.037 . . . . 0.0 113.345 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 29' ' ' ILE . 23.9 t80 -60.97 -43.67 98.46 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.51 -0.744 . . . . 0.0 109.3 168.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -69.06 -31.11 69.64 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.304 -0.873 . . . . 0.0 112.943 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.06 -24.68 67.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 120.029 1.286 . . . . 0.0 113.348 174.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -99.97 -43.7 6.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.837 1.255 . . . . 0.0 113.144 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -114.7 -7.39 12.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.423 1.889 . . . . 0.0 114.203 -161.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m 62.18 9.56 3.25 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.089 2.156 . . . . 0.0 116.473 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.0 mtm105 -119.9 162.33 19.35 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 0.0 110.61 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.8 m -81.72 147.26 29.56 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.345 0.658 . . . . 0.0 109.779 160.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 14.4 tt -58.42 -29.48 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 117.256 2.317 . . . . 0.0 117.256 -151.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.363 1.616 . . . . 0.0 115.363 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.7 m -66.18 -21.38 66.32 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -173.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -160.23 146.01 12.01 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.94 1.257 . . . . 0.0 110.961 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 14.2 m -134.05 20.6 3.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.408 1.483 . . . . 0.0 113.525 -158.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt -104.65 151.93 39.36 Favored Pre-proline 0 CA--C 1.54 0.591 0 C-N-CA 126.208 1.803 . . . . 0.0 111.256 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -61.34 -35.31 84.63 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 121.68 1.587 . . . . 0.0 115.001 -166.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -77.01 -21.73 54.18 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.421 1.488 . . . . 0.0 113.922 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -81.17 -42.26 21.12 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.229 1.412 . . . . 0.0 109.97 170.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 84.5 m -58.77 -43.35 90.37 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.302 -0.874 . . . . 0.0 112.724 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.96 -12.61 59.97 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.24 -39.28 32.02 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 118.525 0.602 . . . . 0.0 113.136 168.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -94.37 -24.45 17.37 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.9 m -112.59 135.41 53.34 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.026 0.93 . . . . 0.0 112.328 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -104.33 148.53 26.28 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.689 . . . . 0.0 110.508 171.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.67 -160.96 28.09 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.6 1.095 . . . . 0.0 111.929 -162.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -125.8 -45.57 1.75 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.865 1.666 . . . . 0.0 112.206 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.21 -38.45 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 118.985 0.812 . . . . 0.0 110.85 173.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -66.34 -46.43 76.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.68 1.592 . . . . 0.0 112.813 176.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -61.52 -43.6 98.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.375 1.07 . . . . 0.0 110.357 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.04 -28.22 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.703 1.201 . . . . 0.0 113.385 174.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.62 -33.23 72.36 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.071 173.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.76 -33.52 66.39 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.689 -1.257 . . . . 0.0 111.633 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.0 mt -59.23 -38.81 80.89 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.882 0.765 . . . . 0.0 112.533 173.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.7 mtmm -102.02 -23.17 14.13 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -136.93 -5.34 1.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -170.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t 53.06 41.89 32.19 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -134.06 161.45 34.82 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.109 1.764 . . . . 0.0 109.631 163.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.1 m -84.41 141.66 30.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 153.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.2 tt -66.89 125.48 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.278 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 . . . . . 0 N--CA 1.486 1.335 0 C-N-CA 125.012 1.325 . . . . 0.0 113.357 172.958 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.776 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -74.11 166.09 24.01 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.568 1.547 . . . . 0.0 113.744 -177.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.7 152.08 28.47 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.157 0.884 . . . . 0.0 113.993 175.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.3 m -119.83 19.83 12.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.247 1.419 . . . . 0.0 113.83 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.6 mmt -104.09 155.59 36.93 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 125.887 1.675 . . . . 0.0 112.101 -174.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.64 -34.42 92.22 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.367 2.044 . . . . 0.0 115.119 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -72.04 -21.67 61.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.235 1.414 . . . . 0.0 114.399 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 -45.75 17.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.385 0.674 . . . . 0.0 109.886 169.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 70.5 m -56.95 -52.03 66.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.922 0.889 . . . . 0.0 111.92 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.8 -21.06 44.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.39 -22.93 78.57 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.916 171.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -116.32 -10.71 11.34 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.811 1.306 . . . . 0.0 114.498 -176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 m -138.35 134.81 34.68 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.695 1.198 . . . . 0.0 111.171 -173.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -99.91 156.34 17.19 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.255 1.422 . . . . 0.0 112.518 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.86 -153.09 29.33 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.292 1.425 . . . . 0.0 112.236 -173.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -125.87 -32.76 2.78 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.574 1.187 . . . . 0.0 113.633 -178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -66.12 -44.22 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.136 0.88 . . . . 0.0 110.106 175.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 t -61.36 -45.78 92.96 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.239 1.415 . . . . 0.0 111.189 177.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.94 -52.38 56.66 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.478 1.111 . . . . 0.0 113.129 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.98 -24.53 67.75 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -175.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.412 ' HB3' ' H ' ' A' ' 29' ' ' ILE . 12.4 t80 -65.89 -36.67 84.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.459 -0.776 . . . . 0.0 111.606 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -71.34 -28.36 64.02 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.524 1.13 . . . . 0.0 112.007 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.6 mt -66.8 -16.25 64.14 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.89 -12.39 7.54 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -143.13 4.6 1.44 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -171.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t 58.28 -22.24 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 129.435 3.094 . . . . 0.0 118.08 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -77.19 160.56 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.777 -1.202 . . . . 0.0 109.994 165.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.4 m -101.95 103.87 14.53 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.642 0.777 . . . . 0.0 110.645 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.412 ' H ' ' HB3' ' A' ' 21' ' ' TYR 0.401 9.6 tp 49.52 -23.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 1 C-N-CA 133.075 4.55 . . . . 0.0 119.463 174.264 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.7 1.6 . . . . 0.0 112.774 -176.179 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.201 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.1 m -114.81 169.82 8.79 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.462 1.505 . . . . 0.0 114.285 -170.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -47.66 115.31 2.15 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.52 1.533 . . . . 0.0 116.713 -167.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.0 m 53.53 18.21 1.35 Allowed 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 116.512 2.042 . . . . 0.0 116.512 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 61.0 mtt -83.4 156.36 65.87 Favored Pre-proline 0 N--CA 1.471 0.594 0 C-N-CA 124.543 1.137 . . . . 0.0 110.84 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -54.92 -35.3 88.99 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.677 2.251 . . . . 0.0 113.961 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.64 -27.29 65.87 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.69 1.132 . . . . 0.0 113.594 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -74.24 -45.64 46.73 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 110.713 168.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.96 -47.68 83.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.244 -0.91 . . . . 0.0 112.963 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.03 -4.25 56.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.699 1.2 . . . . 0.0 113.433 173.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.81 -46.32 7.26 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.875 1.226 . . . . 0.0 111.435 165.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -72.95 -37.39 67.14 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.824 1.25 . . . . 0.0 113.94 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.3 m -139.3 144.78 38.47 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -160.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.93 163.56 13.97 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.161 2.184 . . . . 0.0 112.694 -176.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.49 -144.88 20.83 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.652 1.12 . . . . 0.0 112.085 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -136.18 -37.66 0.71 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.681 1.192 . . . . 0.0 112.371 -172.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.99 -47.57 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.215 1.006 . . . . 0.0 111.455 175.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -72.09 -39.63 68.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.638 0.775 . . . . 0.0 112.191 -174.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -55.6 -47.39 76.57 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.958 0.503 . . . . 0.0 111.045 169.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.31 -29.53 70.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.917 1.287 . . . . 0.0 113.802 174.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -64.2 -40.38 95.96 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.845 -1.159 . . . . 0.0 110.319 175.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.4 t -68.8 -29.95 68.41 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.299 0.639 . . . . 0.0 112.514 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.95 -28.02 69.25 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.087 -1.008 . . . . 0.0 113.458 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -118.62 -29.3 5.45 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -102.76 -15.19 16.35 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.5 1.52 . . . . 0.0 112.626 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.282 8.5 t 51.22 32.12 7.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.121 1.768 . . . . 0.0 114.624 -169.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -131.36 161.32 32.65 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.703 1.601 . . . . 0.0 109.388 168.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 67.6 m -78.47 158.29 28.68 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 161.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.6 tt -71.59 98.2 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 121.039 -1.038 . . . . 0.0 112.418 -174.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 . . . . . 0 N--CA 1.474 0.734 0 C-N-CA 126.961 2.104 . . . . 0.0 111.872 178.2 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.6 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -96.08 -19.46 19.4 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.127 0.971 . . . . 0.0 112.468 164.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.4 127.55 9.07 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.173 0.892 . . . . 0.0 113.209 176.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.3 p -151.76 44.6 0.76 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.249 1.42 . . . . 0.0 112.61 172.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 154.06 92.49 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.777 0.831 . . . . 0.0 111.285 161.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.44 -42.73 45.78 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 122.245 1.963 . . . . 0.0 115.139 -166.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -68.83 -26.48 65.19 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.633 -0.667 . . . . 0.0 112.7 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -88.69 -33.11 17.67 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.416 1.486 . . . . 0.0 112.061 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 94.3 m -57.16 -40.69 77.78 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.116 -0.99 . . . . 0.0 111.325 165.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.22 -1.88 42.5 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 177.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.33 -50.98 2.47 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.292 0.949 . . . . 0.0 112.151 164.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -76.42 -26.58 55.65 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.4 m -118.04 140.79 49.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.552 1.541 . . . . 0.0 111.412 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -114.47 142.68 46.06 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.208 1.403 . . . . 0.0 111.291 -174.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 100.46 -133.7 11.41 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 125.065 1.317 . . . . 0.0 113.462 -171.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.46 -53.1 0.83 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.006 1.322 . . . . 0.0 111.918 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.69 -34.68 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.863 0.865 . . . . 0.0 111.919 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.9 p -63.31 -44.16 95.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.433 1.093 . . . . 0.0 112.469 170.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.94 -43.15 83.95 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.279 1.031 . . . . 0.0 111.062 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.253 0.5 OUTLIER -70.53 -21.58 62.71 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.981 1.264 . . . . 0.0 113.399 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -68.76 -32.71 72.66 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.047 -1.033 . . . . 0.0 111.296 166.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -76.17 -33.05 59.35 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.973 -1.079 . . . . 0.0 111.73 173.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.51 -40.22 96.48 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.258 -0.901 . . . . 0.0 112.681 172.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -91.76 -39.73 11.63 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -128.03 3.72 5.89 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.934 1.294 . . . . 0.0 113.427 -164.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.3 t 63.72 10.96 5.46 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.0 mtm-85 -118.61 169.89 9.42 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.798 1.639 . . . . 0.0 111.4 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 39.6 m -79.52 162.33 25.46 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 157.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.302 16.3 tt -81.41 78.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-O 123.968 1.842 . . . . 0.0 113.024 -173.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.008 2.123 . . . . 0.0 108.661 168.32 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.154 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -78.44 163.3 25.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.218 1.807 . . . . 0.0 112.779 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.2 -157.74 14.81 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 125.466 1.508 . . . . 0.0 111.699 -174.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 57.45 3.6 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.599 -1.53 . . . . 0.0 111.345 173.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.1 mmt -111.37 141.91 25.39 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 111.499 -170.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.47 -37.52 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.396 2.73 . . . . 0.0 115.506 -178.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -68.8 -27.29 65.73 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.649 1.58 . . . . 0.0 114.426 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -82.74 -35.63 26.48 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.334 1.054 . . . . 0.0 110.145 173.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.4 m -59.12 -49.62 77.16 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.388 1.075 . . . . 0.0 112.566 174.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.31 5.35 15.01 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 173.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.58 -62.06 1.82 Allowed Glycine 0 CA--C 1.533 1.206 0 O-C-N 121.504 -0.748 . . . . 0.0 111.274 156.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -72.17 -26.78 62.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.055 1.742 . . . . 0.0 115.261 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.0 m -121.82 148.94 44.05 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.868 1.267 . . . . 0.0 112.297 -170.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -121.29 140.32 52.23 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.202 1.801 . . . . 0.0 110.316 -176.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.59 162.74 33.82 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 123.511 0.577 . . . . 0.0 113.159 -170.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -82.47 -39.95 21.8 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.99 1.316 . . . . 0.0 110.689 -164.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.03 -39.12 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 124.861 1.264 . . . . 0.0 111.308 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.5 t -72.15 -43.36 64.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.891 0.769 . . . . 0.0 111.971 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -58.29 -42.69 87.13 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.31 -0.869 . . . . 0.0 111.651 168.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -66.94 -23.86 66.01 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 173.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -69.63 -36.1 75.83 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.18 -1.575 . . . . 0.0 110.654 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.8 t -71.34 -33.1 69.31 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.806 -0.559 . . . . 0.0 111.713 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.25 -39.09 78.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.04 0.837 . . . . 0.0 112.521 174.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -105.45 -26.28 12.0 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -168.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -135.17 5.47 3.28 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.225 1.41 . . . . 0.0 113.092 -171.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.8 m 54.64 28.08 9.49 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 175.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -132.27 166.49 21.77 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.309 1.844 . . . . 0.0 110.88 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 m -70.18 163.62 25.97 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 151.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 11.8 tt -58.34 97.05 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -169.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 . . . . . 0 C--O 1.25 1.13 0 C-N-CA 128.01 2.524 . . . . 0.0 111.252 -173.777 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.263 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 p -68.84 108.3 3.4 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.002 0.906 . . . . 0.0 110.219 170.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.6 8.29 62.47 Favored Glycine 0 CA--C 1.534 1.256 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.5 p -152.2 117.09 5.14 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.035 1.334 . . . . 0.0 112.243 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 76.4 mtm -84.34 157.32 62.13 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.733 1.213 . . . . 0.0 112.822 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.88 -36.53 98.17 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.033 2.489 . . . . 0.0 113.61 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.18 -27.74 68.91 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.912 1.285 . . . . 0.0 114.115 177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -74.8 -48.74 23.73 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.174 0.99 . . . . 0.0 110.59 166.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 72.6 m -57.69 -43.07 84.86 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.41 -11.35 59.94 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 176.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.55 -41.7 10.99 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.577 1.084 . . . . 0.0 112.65 166.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -76.65 -26.72 55.18 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 118.576 1.188 . . . . 0.0 113.327 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.14 145.95 34.78 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -165.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -118.46 148.81 42.2 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.528 1.931 . . . . 0.0 112.414 -171.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 101.52 -138.46 13.89 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.654 1.121 . . . . 0.0 112.466 -170.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -132.36 -51.55 0.94 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.487 1.915 . . . . 0.0 112.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.9 t -70.73 -31.8 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.599 0.76 . . . . 0.0 111.239 -173.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.4 p -60.34 -53.23 60.08 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.431 1.492 . . . . 0.0 111.877 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -58.39 -47.95 82.21 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.359 1.464 . . . . 0.0 111.587 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.29 -28.38 69.68 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.113 1.765 . . . . 0.0 113.67 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -71.06 -39.05 72.47 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.096 -1.003 . . . . 0.0 110.327 172.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.28 -33.09 74.57 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.347 -0.845 . . . . 0.0 111.803 176.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.1 mt -61.09 -28.74 69.3 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.982 -1.074 . . . . 0.0 113.283 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -103.41 -20.17 14.16 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -148.09 3.15 0.69 Allowed 'General case' 0 CA--C 1.555 1.136 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 -170.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.4 m 56.66 -13.38 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -76.34 172.14 13.39 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.099 1.318 . . . . 0.0 109.887 159.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.6 m -110.72 159.72 17.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.821 0.848 . . . . 0.0 111.252 161.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 16.4 tt -66.71 128.6 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -170.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? . . . . . 0 C--O 1.255 1.37 0 C-N-CA 128.74 2.816 . . . . 0.0 110.406 175.959 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.876 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 m -97.9 162.36 13.28 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.642 0.777 . . . . 0.0 112.845 -173.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.56 -126.28 8.19 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.524 0.583 . . . . 0.0 113.365 168.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 59.1 m -78.24 61.14 2.66 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.917 1.287 . . . . 0.0 113.645 -168.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 50.0 mtt -136.66 121.18 12.64 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 127.458 2.303 . . . . 0.0 109.206 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.61 -37.24 95.45 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.754 2.303 . . . . 0.0 113.869 -177.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.5 -8.05 55.73 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -84.64 -46.02 11.92 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 163.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.3 m -56.26 -59.65 4.64 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.318 1.047 . . . . 0.0 112.513 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.06 -0.09 26.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.87 -26.02 54.54 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.774 1.178 . . . . 0.0 114.011 169.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -125.57 -22.1 4.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.6 134.48 53.14 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.718 1.145 . . . . 0.0 111.054 -174.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -115.24 143.59 45.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.411 1.484 . . . . 0.0 110.535 -164.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.03 -141.93 15.45 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 124.214 0.912 . . . . 0.0 112.876 -173.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -127.73 -45.87 1.44 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.959 1.304 . . . . 0.0 112.617 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -63.92 -39.07 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 119.374 0.988 . . . . 0.0 112.253 -177.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.9 p -63.8 -48.09 78.25 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.592 1.157 . . . . 0.0 111.983 175.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.56 -52.34 65.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.066 1.346 . . . . 0.0 111.486 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -56.96 -34.32 67.93 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.285 1.834 . . . . 0.0 113.189 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -67.36 -36.81 82.14 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 121.271 -0.893 . . . . 0.0 110.536 173.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.9 t -76.83 -31.55 56.98 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.011 -1.056 . . . . 0.0 112.561 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.63 -34.28 75.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.378 0.99 . . . . 0.0 111.816 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -87.23 -44.43 11.46 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 174.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -118.16 -5.59 10.91 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.815 1.246 . . . . 0.0 114.065 -160.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.0 m 60.84 20.9 11.09 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.884 2.073 . . . . 0.0 115.881 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -137.33 170.49 15.99 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 129.267 3.027 . . . . 0.0 108.018 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -107.38 142.42 37.23 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.87 1.668 . . . . 0.0 112.11 173.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.1 tt -52.59 134.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.374 1.47 . . . . 0.0 113.212 -169.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? . . . . . 0 C--O 1.25 1.09 0 CA-C-O 116.658 -1.639 . . . . 0.0 111.61 170.399 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.425 ' HA3' ' SD ' ' A' ' 5' ' ' MET . . . . . . . . 0 N--CA 1.471 0.976 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -69.44 148.58 49.38 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.448 1.099 . . . . 0.0 113.304 -173.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.28 -167.08 40.92 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.647 1.118 . . . . 0.0 113.828 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 59.6 m -77.79 56.22 1.49 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.192 1.797 . . . . 0.0 111.933 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.425 ' SD ' ' HA3' ' A' ' 1' ' ' GLY . 39.2 mtt -71.36 160.87 81.26 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.906 1.283 . . . . 0.0 111.206 170.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.06 -34.25 98.86 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.805 1.67 . . . . 0.0 115.442 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -63.58 -41.17 98.4 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.009 1.277 . . . . 0.0 112.91 176.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -63.49 -46.92 83.92 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.973 0.909 . . . . 0.0 110.47 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 85.0 m -67.14 -38.13 85.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.996 0.918 . . . . 0.0 113.243 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.0 -7.13 57.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.34 -44.42 9.62 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 123.65 0.643 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -78.7 -33.97 46.43 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.2 m -113.98 158.44 21.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.914 1.285 . . . . 0.0 112.768 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 -119.83 147.3 44.83 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.284 1.434 . . . . 0.0 110.524 170.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.95 -155.79 20.04 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.89 1.233 . . . . 0.0 111.629 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -129.13 -42.86 1.34 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.431 1.115 . . . . 0.0 112.656 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -64.82 -36.6 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.297 0.953 . . . . 0.0 110.906 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.7 p -59.29 -43.31 92.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.08 0.952 . . . . 0.0 112.49 172.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -65.97 -45.62 81.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.044 1.338 . . . . 0.0 111.006 175.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.04 -33.37 75.58 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.799 1.24 . . . . 0.0 113.66 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -67.93 -38.93 83.49 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.639 -1.288 . . . . 0.0 110.513 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -65.64 -31.48 72.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.404 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.4 mt -57.69 -32.16 67.07 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.716 1.144 . . . . 0.0 112.963 177.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -104.22 -33.13 8.81 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.167 1.787 . . . . 0.0 114.367 -175.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -123.76 -3.47 8.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.639 1.176 . . . . 0.0 113.552 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 79.8 m 57.13 13.77 1.75 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -175.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -115.77 160.24 20.37 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.093 1.757 . . . . 0.0 110.89 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 m -74.9 155.56 37.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 159.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 19.2 tt -70.56 111.1 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.364 -0.835 . . . . 0.0 111.898 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 . . . . . 0 C--O 1.249 1.073 0 C-N-CA 128.641 2.776 . . . . 0.0 110.479 174.366 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.731 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 p -112.2 110.72 21.13 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.702 2.001 . . . . 0.0 111.22 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 154.84 -170.88 33.15 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 126.26 1.886 . . . . 0.0 112.771 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 33.9 m -80.96 54.34 2.18 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.0 1.32 . . . . 0.0 110.537 174.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 44.0 mtt -84.71 151.61 58.56 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.705 2.002 . . . . 0.0 111.256 -171.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.11 -34.64 79.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.389 1.393 . . . . 0.0 114.5 -170.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -78.26 -14.03 59.61 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -83.9 -42.24 16.56 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.127 0.971 . . . . 0.0 110.513 165.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.5 m -62.57 -41.57 99.01 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.38 -0.825 . . . . 0.0 112.488 177.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.29 -5.45 49.48 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 170.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.18 -31.6 27.98 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.529 1.061 . . . . 0.0 113.178 167.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -106.9 -19.66 13.57 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.3 137.29 54.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.82 1.248 . . . . 0.0 111.049 -175.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -106.18 146.44 30.26 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.859 1.264 . . . . 0.0 110.661 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.0 -143.95 16.98 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 123.954 0.787 . . . . 0.0 112.249 -168.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -139.42 -43.84 0.45 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.612 1.165 . . . . 0.0 113.223 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.2 t -64.11 -37.43 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.657 0.783 . . . . 0.0 110.145 174.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 91.6 p -61.78 -45.43 93.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.976 1.31 . . . . 0.0 112.989 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.95 -48.22 81.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.396 1.479 . . . . 0.0 110.816 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.99 -30.16 70.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.997 1.319 . . . . 0.0 113.549 175.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -69.96 -41.39 74.58 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.088 -1.007 . . . . 0.0 110.199 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.1 t -62.97 -35.35 79.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.295 -0.86 . . . . 0.0 112.606 176.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.79 -38.81 67.76 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.587 0.708 . . . . 0.0 111.968 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -91.51 -53.55 4.27 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.923 1.289 . . . . 0.0 111.624 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -103.86 -1.96 26.99 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.741 1.616 . . . . 0.0 114.574 -162.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.5 m 56.28 30.21 16.3 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.119 1.368 . . . . 0.0 114.486 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -139.2 160.1 40.6 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.061 2.144 . . . . 0.0 111.002 176.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -82.87 137.17 34.36 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 162.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 tt -61.14 147.16 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 122.005 -0.435 . . . . 0.0 111.663 -176.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.248 0 C-N-CA 125.158 1.383 . . . . 0.0 113.618 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.3 p -138.18 167.54 21.62 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.344 1.058 . . . . 0.0 113.141 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 169.79 -171.58 43.38 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.34 0.971 . . . . 0.0 111.966 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.03 62.44 2.16 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.896 1.278 . . . . 0.0 111.892 178.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 28.7 mtt -74.13 136.24 76.15 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 125.87 1.668 . . . . 0.0 111.526 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -56.34 -39.13 93.32 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.609 2.206 . . . . 0.0 113.999 173.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -35.48 79.39 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.118 -0.989 . . . . 0.0 112.648 174.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -76.7 -31.84 57.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.995 0.918 . . . . 0.0 112.08 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.2 m -60.13 -43.87 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.979 -1.076 . . . . 0.0 112.145 168.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.58 -19.47 45.52 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.62 -48.03 77.24 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 121.167 -0.958 . . . . 0.0 111.546 165.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -75.08 -55.55 5.62 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.504 1.122 . . . . 0.0 113.609 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.85 146.41 25.98 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.013 0.925 . . . . 0.0 112.434 -164.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmt-85 -106.41 124.81 50.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.697 1.199 . . . . 0.0 111.795 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.15 -157.61 15.46 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.765 1.174 . . . . 0.0 114.548 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -105.48 -53.41 2.66 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.568 1.547 . . . . 0.0 110.779 -178.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.0 t -63.31 -37.28 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.538 0.735 . . . . 0.0 111.498 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.3 p -69.74 -45.32 68.4 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.363 1.065 . . . . 0.0 112.822 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.47 -49.64 76.77 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.536 1.135 . . . . 0.0 110.857 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -61.16 -28.09 68.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.061 1.344 . . . . 0.0 113.758 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.78 -40.67 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.92 -1.113 . . . . 0.0 110.918 172.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.0 t -67.22 -28.38 68.02 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.426 -0.796 . . . . 0.0 112.211 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.58 -16.67 63.93 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.35 -49.42 2.96 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.873 1.269 . . . . 0.0 113.874 173.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -101.03 -6.45 24.4 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.542 1.537 . . . . 0.0 113.816 -169.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.7 m 58.87 23.39 11.3 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.9 mtm105 -128.84 163.81 24.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.146 2.178 . . . . 0.0 110.431 170.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.3 m -71.91 153.32 41.93 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.762 -0.586 . . . . 0.0 109.927 157.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.3 tt -66.77 93.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.492 1.117 . . . . 0.0 113.096 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 125.835 1.654 . . . . 0.0 110.325 173.469 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 CA--C 1.548 0.869 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.05 -37.78 79.5 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.558 2.839 . . . . 0.0 115.463 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.58 -31.22 72.14 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.678 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -70.63 -43.53 69.03 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.702 -0.624 . . . . 0.0 110.834 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.6 m -63.06 -59.03 5.36 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.512 0.596 . . . . 0.0 112.243 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.51 -25.06 59.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -172.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.77 64.04 Favored Glycine 0 CA--C 1.537 1.422 0 CA-C-O 118.673 -1.07 . . . . 0.0 115.101 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -132.66 -30.54 1.43 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.2 m -90.36 131.49 36.12 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.725 1.148 . . . . 0.0 111.013 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.91 155.01 39.14 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -165.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.1 -128.2 8.88 Favored Glycine 0 N--CA 1.467 0.705 0 C-N-CA 123.723 0.678 . . . . 0.0 112.429 159.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -137.71 -32.32 0.76 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.463 1.105 . . . . 0.0 113.345 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 68.1 t -70.0 -47.13 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.039 1.336 . . . . 0.0 112.156 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.5 t -63.44 -41.57 98.66 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 121.197 -0.939 . . . . 0.0 111.039 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -56.05 -48.88 75.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.398 0.679 . . . . 0.0 111.436 170.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -65.51 -27.16 68.28 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.103 1.361 . . . . 0.0 113.772 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -69.35 -35.87 76.31 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 120.581 -1.324 . . . . 0.0 110.431 170.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.89 -42.16 58.36 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.566 -0.709 . . . . 0.0 110.626 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.72 -42.25 96.88 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.939 -1.101 . . . . 0.0 112.443 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 mtmm -78.54 -38.45 40.48 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.73 1.88 1.19 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -156.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.25 86.0 m 56.12 41.39 29.57 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.276 2.231 . . . . 0.0 116.355 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -129.83 158.75 38.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.696 1.599 . . . . 0.0 110.457 169.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.7 m -116.18 139.0 50.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 122.341 1.067 . . . . 0.0 111.881 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 tt . . . . . 0 N--CA 1.471 0.613 0 C-N-CA 125.954 1.701 . . . . 0.0 112.844 -165.757 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 64.4 mtm . . . . . 0 CA--C 1.541 0.631 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.292 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.87 -31.93 96.31 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.195 1.93 . . . . 0.0 114.939 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.9 -20.73 62.47 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 114.708 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -85.37 -46.3 11.08 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.968 1.707 . . . . 0.0 110.224 168.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.2 m -59.95 -48.98 79.5 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.652 0.781 . . . . 0.0 112.989 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.15 -10.16 59.5 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 173.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.46 -33.31 39.45 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.84 1.209 . . . . 0.0 113.175 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -98.02 -19.64 17.88 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.1 m -130.73 145.03 51.84 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.435 1.094 . . . . 0.0 112.687 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 mmp_? -99.45 162.22 13.16 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.38 2.272 . . . . 0.0 110.561 169.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 94.99 -145.27 17.64 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-O 118.974 -0.903 . . . . 0.0 112.101 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -140.7 -53.4 0.49 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.106 1.453 . . . . 0.0 114.724 -169.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -70.63 -32.53 49.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.818 0.847 . . . . 0.0 110.436 175.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.0 p -54.12 -54.74 35.46 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 125.97 1.708 . . . . 0.0 111.854 168.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -62.86 -42.14 99.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.628 1.171 . . . . 0.0 111.92 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.69 -28.47 60.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -175.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -65.77 -30.57 71.24 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.159 -1.588 . . . . 0.0 110.197 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.0 t -70.22 -25.58 63.46 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.657 -0.652 . . . . 0.0 111.689 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 mt -75.38 -29.45 59.86 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.7 -32.9 11.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.045 0.938 . . . . 0.0 113.359 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -137.91 10.37 2.85 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.946 1.299 . . . . 0.0 113.755 -162.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.0 m 63.43 7.45 2.98 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.893 2.553 . . . . 0.0 117.893 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.6 mtm105 -131.87 159.97 37.06 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.26 1.424 . . . . 0.0 111.645 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 m -78.54 159.01 28.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 118.257 0.481 . . . . 0.0 110.236 158.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 15.2 tt . . . . . 0 N--CA 1.471 0.624 0 CA-C-O 123.522 1.629 . . . . 0.0 114.653 -156.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 57.7 mtt . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.33 -40.67 65.96 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.36 2.04 . . . . 0.0 113.611 -178.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -69.42 -7.04 34.19 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 174.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -96.68 -43.58 7.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 111.074 166.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 89.6 m -61.37 -30.9 70.82 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.853 -1.155 . . . . 0.0 113.661 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.76 -5.06 54.56 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.54 -27.34 15.16 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.738 1.161 . . . . 0.0 113.477 163.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -88.05 -28.84 21.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 60.5 m -131.43 149.9 52.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.631 1.173 . . . . 0.0 112.873 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -110.81 135.16 51.8 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.311 1.444 . . . . 0.0 110.715 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.34 -145.07 18.63 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.258 1.409 . . . . 0.0 112.713 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -137.99 -44.77 0.52 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.073 1.349 . . . . 0.0 112.911 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.85 -41.0 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.359 1.064 . . . . 0.0 109.978 170.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -59.79 -43.26 94.51 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.88 0.872 . . . . 0.0 112.419 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.16 -27.51 68.07 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.672 1.189 . . . . 0.0 113.756 175.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -78.75 -36.16 43.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.584 1.083 . . . . 0.0 113.28 167.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.05 -43.92 95.04 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.416 -1.428 . . . . 0.0 111.03 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.8 t -58.37 -27.2 63.99 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.558 1.143 . . . . 0.0 113.642 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -62.4 -29.04 70.2 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.908 1.231 . . . . 0.0 113.563 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -111.0 -38.74 4.99 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.131 0.972 . . . . 0.0 113.054 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -92.58 -22.66 19.38 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -171.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.7 m 55.8 21.43 4.74 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.703 1.601 . . . . 0.0 115.091 -173.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -117.09 170.7 8.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.733 2.013 . . . . 0.0 109.485 161.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 m -77.31 174.1 11.16 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 155.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.263 14.4 tt . . . . . 0 CA--C 1.548 0.886 0 O-C-N 120.774 -1.204 . . . . 0.0 113.904 -167.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 60.0 mtm . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.83 -44.24 50.93 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.514 2.809 . . . . 0.0 115.078 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pm0 -74.63 -8.54 56.69 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -91.88 -42.1 10.24 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.734 1.614 . . . . 0.0 110.482 167.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 93.8 m -59.64 -46.32 89.36 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.183 0.993 . . . . 0.0 112.138 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -16.16 61.89 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.07 -27.55 70.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.727 -1.041 . . . . 0.0 113.135 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -104.46 -35.7 7.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.775 1.768 . . . . 0.0 115.775 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.1 m -106.1 146.61 29.96 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.015 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -117.82 137.53 52.7 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.957 1.303 . . . . 0.0 111.504 -171.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.15 -156.53 25.26 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 123.725 0.678 . . . . 0.0 111.946 -161.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -116.49 -46.94 2.75 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 0.0 112.216 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.99 -35.79 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.735 0.814 . . . . 0.0 110.964 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.6 p -66.09 -45.17 82.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.786 1.234 . . . . 0.0 112.752 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -63.63 -43.5 96.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.217 1.007 . . . . 0.0 110.461 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.07 -29.16 70.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.363 1.065 . . . . 0.0 113.437 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -70.87 -37.13 73.05 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.147 -0.971 . . . . 0.0 110.356 175.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 37.2 t -64.42 -34.59 78.53 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.96 -1.088 . . . . 0.0 111.374 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.72 -34.81 73.39 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -119.72 2.1 11.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.196 1.398 . . . . 0.0 114.012 -168.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -145.17 -15.27 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.909 1.283 . . . . 0.0 114.121 -177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.0 m 58.76 37.78 24.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.902 1.281 . . . . 0.0 114.032 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 54.1 mtp85 -141.76 161.52 37.75 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.64 2.376 . . . . 0.0 110.327 171.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -86.11 135.53 33.57 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.807 0.73 . . . . 0.0 110.122 164.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 2.7 tt . . . . . 0 N--CA 1.478 0.938 0 O-C-N 121.261 -0.899 . . . . 0.0 110.165 173.722 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 52.9 mtt . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.71 -35.88 94.0 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.548 2.832 . . . . 0.0 115.755 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -71.95 -36.47 69.89 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.459 0.704 . . . . 0.0 111.944 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.22 -37.2 77.9 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.595 -0.69 . . . . 0.0 111.152 175.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.8 m -61.7 -54.68 39.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.484 0.714 . . . . 0.0 111.603 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.66 60.29 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.67 2.48 39.72 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.803 1.192 . . . . 0.0 115.731 172.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -143.34 -39.15 0.32 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.291 1.545 . . . . 0.0 114.259 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 83.0 m -94.67 141.56 28.47 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.167 0.987 . . . . 0.0 111.222 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -104.11 159.24 15.84 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 112.731 -164.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.05 -135.03 12.83 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.503 1.525 . . . . 0.0 113.711 175.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.1 tttp -132.76 -45.47 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.349 1.46 . . . . 0.0 112.912 174.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -61.82 -39.93 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.038 0.835 . . . . 0.0 112.087 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.1 t -76.61 -38.85 54.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.632 0.773 . . . . 0.0 112.316 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -56.71 -50.66 71.5 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.429 -0.794 . . . . 0.0 111.189 168.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -58.86 -29.25 66.82 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.945 1.698 . . . . 0.0 113.212 173.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -68.33 -43.34 77.76 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.082 -1.011 . . . . 0.0 110.862 174.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.39 -26.58 66.52 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -62.75 -26.68 68.82 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 120.973 -1.079 . . . . 0.0 113.612 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -102.56 -38.34 7.57 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.921 1.289 . . . . 0.0 113.605 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -118.51 -14.0 9.69 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -161.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.8 t 56.66 -11.75 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.588 2.355 . . . . 0.0 116.979 -172.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -75.16 167.27 22.24 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.758 -1.214 . . . . 0.0 109.489 151.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.0 m -98.86 164.02 12.37 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.262 1.025 . . . . 0.0 109.937 159.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 tt . . . . . 0 CA--C 1.551 0.988 0 O-C-N 121.245 -0.909 . . . . 0.0 113.442 -163.189 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 119.124 -0.465 . . . . 0.0 112.161 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -58.54 -35.91 98.05 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.038 1.825 . . . . 0.0 114.496 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -34.49 74.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.287 1.035 . . . . 0.0 113.442 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.14 -48.87 18.98 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.085 1.354 . . . . 0.0 110.756 170.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.1 m -63.87 -39.44 94.21 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.5 53.15 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 174.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.68 -23.96 24.61 Favored Glycine 0 CA--C 1.538 1.528 0 C-N-CA 125.093 1.33 . . . . 0.0 113.456 165.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -81.44 -42.85 19.75 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.504 1.122 . . . . 0.0 112.745 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 91.1 m -135.88 147.81 48.35 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.518 1.127 . . . . 0.0 113.41 -162.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -114.89 147.88 39.35 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.916 1.687 . . . . 0.0 110.415 -169.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.51 -142.44 16.16 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 -164.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.05 -43.01 0.26 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.581 1.191 . . . . 0.0 113.646 -178.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.55 -37.6 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.421 0.688 . . . . 0.0 110.964 172.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.2 p -61.55 -44.65 96.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.943 1.297 . . . . 0.0 112.388 172.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.07 -48.46 78.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.821 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.39 -33.35 71.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.352 1.461 . . . . 0.0 112.904 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.99 -40.52 91.27 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.933 -1.104 . . . . 0.0 110.608 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.2 t -65.38 -35.57 81.36 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.562 0.745 . . . . 0.0 112.835 173.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.12 -36.17 67.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.577 1.08 . . . . 0.0 112.338 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -99.54 -35.87 9.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.988 1.315 . . . . 0.0 113.952 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -126.81 -1.3 6.65 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.415 1.086 . . . . 0.0 113.508 -166.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 58.58 -22.62 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 129.001 2.92 . . . . 0.0 117.84 -175.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -69.88 174.2 5.52 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.012 1.725 . . . . 0.0 109.837 163.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.74 158.55 19.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 111.03 161.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.6 tt . . . . . 0 N--CA 1.473 0.697 0 C-N-CA 125.05 1.34 . . . . 0.0 113.622 -173.243 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -53.03 -42.55 63.78 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.632 2.888 . . . . 0.0 114.886 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.68 -27.91 69.57 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.74 1.216 . . . . 0.0 113.986 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -80.92 -38.03 28.57 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 111.687 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.7 m -54.1 -48.05 71.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.317 0.647 . . . . 0.0 111.145 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.09 -27.91 61.12 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.6 -38.41 78.37 Favored Glycine 0 CA--C 1.536 1.346 0 O-C-N 121.346 -0.847 . . . . 0.0 113.573 173.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -85.06 -28.32 25.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.635 1.174 . . . . 0.0 113.716 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.1 m -126.61 138.96 53.51 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.396 0.998 . . . . 0.0 113.095 -166.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -98.56 137.28 37.45 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.021 1.728 . . . . 0.0 111.998 -170.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.14 -139.51 14.58 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.221 0.915 . . . . 0.0 112.416 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -136.88 -51.72 0.68 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.795 1.638 . . . . 0.0 112.819 -174.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.35 -38.51 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 0.0 110.827 174.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 86.5 p -58.51 -45.6 88.46 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.937 0.895 . . . . 0.0 112.512 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -62.91 -51.09 68.32 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.567 1.547 . . . . 0.0 110.553 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.62 -26.41 68.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.405 1.482 . . . . 0.0 113.801 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -62.99 -42.93 99.98 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.566 -1.334 . . . . 0.0 110.333 170.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -70.58 -33.12 70.73 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 111.629 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.23 -29.7 68.93 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mtmm -112.3 -22.33 10.96 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -130.94 -9.05 3.91 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.959 1.304 . . . . 0.0 113.557 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.284 7.8 t 47.57 40.06 10.87 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.512 1.925 . . . . 0.0 114.405 -172.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -136.03 159.9 40.28 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.615 2.366 . . . . 0.0 109.371 164.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.44 147.9 24.26 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.488 0.585 . . . . 0.0 111.13 163.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.4 tt . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 124.937 1.295 . . . . 0.0 111.52 -167.787 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mtp . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 118.868 -0.587 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.04 -39.35 91.73 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.587 2.192 . . . . 0.0 114.564 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.47 -25.97 64.34 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -71.39 -45.07 63.71 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.121 -0.987 . . . . 0.0 110.705 170.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 81.0 m -58.06 -49.74 75.87 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.403 0.681 . . . . 0.0 112.528 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.71 -22.22 43.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.23 -28.69 72.46 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 118.748 -1.029 . . . . 0.0 113.518 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -103.44 -37.41 7.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.184 1.492 . . . . 0.0 114.371 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.47 144.29 37.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.181 1.355 . . . . 0.0 113.288 -169.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -113.56 137.47 51.52 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.056 1.342 . . . . 0.0 111.089 -165.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.08 -160.97 17.53 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.056 0.836 . . . . 0.0 112.695 -168.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -114.69 -44.13 3.09 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.665 1.586 . . . . 0.0 111.146 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.93 -38.78 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.485 0.714 . . . . 0.0 111.556 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -63.62 -48.01 79.02 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.224 1.409 . . . . 0.0 112.194 176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.32 -46.91 86.61 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.872 1.269 . . . . 0.0 111.333 175.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.44 -23.2 64.58 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.841 0.856 . . . . 0.0 113.023 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.32 -36.26 83.51 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.471 -1.393 . . . . 0.0 109.953 168.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.47 -35.3 46.84 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.461 -0.774 . . . . 0.0 112.088 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -59.16 -40.13 84.62 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.03 0.832 . . . . 0.0 112.02 173.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -93.6 -30.87 14.74 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -139.8 3.94 2.08 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -164.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.281 4.3 t 50.83 19.18 0.59 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 128.025 2.53 . . . . 0.0 117.215 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.1 mmt-85 -111.48 168.46 9.53 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.475 1.51 . . . . 0.0 109.181 163.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -99.07 160.98 13.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.496 0.665 . . . . 0.0 111.122 163.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 14.7 tt . . . . . 0 CA--C 1.54 0.569 0 O-C-N 121.643 -0.66 . . . . 0.0 111.061 -178.724 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 mmt . . . . . 0 CA--C 1.544 0.718 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -55.61 -40.47 85.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.404 2.736 . . . . 0.0 116.32 -171.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -72.11 -29.12 63.77 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.465 1.106 . . . . 0.0 112.527 175.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -81.63 -29.74 33.11 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.056 1.343 . . . . 0.0 112.109 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 92.2 m -57.09 -42.87 81.53 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.079 -1.013 . . . . 0.0 110.546 164.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.03 -2.81 38.96 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -50.73 3.91 Favored Glycine 0 CA--C 1.534 1.235 0 O-C-N 121.314 -0.866 . . . . 0.0 111.61 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.45 -33.29 74.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.721 0.808 . . . . 0.0 113.054 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.4 m -136.87 144.1 43.39 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 0.0 112.641 -165.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -132.11 142.31 49.46 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.306 -0.871 . . . . 0.0 112.42 -168.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.18 -152.71 18.0 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.539 1.542 . . . . 0.0 111.323 -165.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -118.9 -45.41 2.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.932 1.693 . . . . 0.0 112.019 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.14 -36.42 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.185 1.394 . . . . 0.0 111.143 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 64.4 p -57.97 -45.83 86.1 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.118 0.967 . . . . 0.0 111.856 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -66.21 -47.73 72.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.316 1.046 . . . . 0.0 111.821 174.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -57.93 -32.16 67.52 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.185 1.394 . . . . 0.0 114.07 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.03 -34.07 74.63 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.928 174.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 48.1 t -77.56 -29.22 52.05 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.081 -1.012 . . . . 0.0 111.931 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.69 -38.69 91.4 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -98.96 -28.19 13.53 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -173.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -139.94 -1.43 1.59 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -166.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t 44.21 57.93 4.01 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.573 1.549 . . . . 0.0 113.334 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -139.78 167.66 21.6 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.918 2.887 . . . . 0.0 108.696 170.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.4 m -128.33 144.99 51.2 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.395 0.678 . . . . 0.0 111.312 170.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.472 0.631 0 C-N-CA 123.425 0.69 . . . . 0.0 112.826 -165.15 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 59.7 mtt . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 118.637 -0.697 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.6 -38.78 92.45 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.418 2.078 . . . . 0.0 115.079 -169.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -68.68 -30.61 69.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 114.286 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -82.52 -33.42 28.25 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.081 0.855 . . . . 0.0 110.792 173.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.2 m -65.49 -31.47 72.56 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.054 0.942 . . . . 0.0 113.27 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.43 17.0 19.94 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.232 1.413 . . . . 0.0 114.07 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.86 -40.09 85.05 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.767 1.175 . . . . 0.0 113.597 173.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -128.08 7.04 6.0 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.04 1.736 . . . . 0.0 113.637 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.2 m -137.12 139.24 41.07 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.711 1.604 . . . . 0.0 112.012 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -111.79 174.39 5.9 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.577 1.951 . . . . 0.0 111.641 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 -158.49 39.48 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.425 1.012 . . . . 0.0 113.357 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -113.42 -46.37 3.07 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.767 1.627 . . . . 0.0 111.518 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.3 t -60.92 -45.18 98.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 118.795 0.725 . . . . 0.0 111.771 -171.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -80.09 -38.28 32.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.171 0.588 . . . . 0.0 112.121 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -59.12 -48.39 81.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.41 -0.806 . . . . 0.0 112.065 170.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -22.97 61.51 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.48 1.037 . . . . 0.0 113.345 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.45 ' CD2' ' HA ' ' A' ' 29' ' ' ILE . 23.9 t80 -60.97 -43.67 98.46 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.51 -0.744 . . . . 0.0 109.3 168.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -69.06 -31.11 69.64 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.304 -0.873 . . . . 0.0 112.943 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.06 -24.68 67.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 120.029 1.286 . . . . 0.0 113.348 174.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -99.97 -43.7 6.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.837 1.255 . . . . 0.0 113.144 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -114.7 -7.39 12.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.423 1.889 . . . . 0.0 114.203 -161.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m 62.18 9.56 3.25 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.089 2.156 . . . . 0.0 116.473 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.0 mtm105 -119.9 162.33 19.35 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 0.0 110.61 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.8 m -81.72 147.26 29.56 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.345 0.658 . . . . 0.0 109.779 160.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.45 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 14.4 tt . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 117.256 2.317 . . . . 0.0 117.256 -151.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -61.34 -35.31 84.63 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 121.68 1.587 . . . . 0.0 115.001 -166.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -77.01 -21.73 54.18 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.421 1.488 . . . . 0.0 113.922 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -81.17 -42.26 21.12 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.229 1.412 . . . . 0.0 109.97 170.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 84.5 m -58.77 -43.35 90.37 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.302 -0.874 . . . . 0.0 112.724 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.96 -12.61 59.97 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.24 -39.28 32.02 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 118.525 0.602 . . . . 0.0 113.136 168.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -94.37 -24.45 17.37 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.9 m -112.59 135.41 53.34 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.026 0.93 . . . . 0.0 112.328 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -104.33 148.53 26.28 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.689 . . . . 0.0 110.508 171.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.67 -160.96 28.09 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.6 1.095 . . . . 0.0 111.929 -162.006 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -125.8 -45.57 1.75 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.865 1.666 . . . . 0.0 112.206 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.21 -38.45 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 118.985 0.812 . . . . 0.0 110.85 173.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -66.34 -46.43 76.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.68 1.592 . . . . 0.0 112.813 176.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -61.52 -43.6 98.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.375 1.07 . . . . 0.0 110.357 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.04 -28.22 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.703 1.201 . . . . 0.0 113.385 174.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.62 -33.23 72.36 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.071 173.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.76 -33.52 66.39 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.689 -1.257 . . . . 0.0 111.633 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.0 mt -59.23 -38.81 80.89 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.882 0.765 . . . . 0.0 112.533 173.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.7 mtmm -102.02 -23.17 14.13 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -136.93 -5.34 1.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -170.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t 53.06 41.89 32.19 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -134.06 161.45 34.82 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.109 1.764 . . . . 0.0 109.631 163.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.1 m -84.41 141.66 30.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 153.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.278 -173.726 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 118.858 -0.591 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.64 -34.42 92.22 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.367 2.044 . . . . 0.0 115.119 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -72.04 -21.67 61.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.235 1.414 . . . . 0.0 114.399 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 -45.75 17.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.385 0.674 . . . . 0.0 109.886 169.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 70.5 m -56.95 -52.03 66.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.922 0.889 . . . . 0.0 111.92 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.8 -21.06 44.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.39 -22.93 78.57 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.916 171.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -116.32 -10.71 11.34 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.811 1.306 . . . . 0.0 114.498 -176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 m -138.35 134.81 34.68 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.695 1.198 . . . . 0.0 111.171 -173.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -99.91 156.34 17.19 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.255 1.422 . . . . 0.0 112.518 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.86 -153.09 29.33 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.292 1.425 . . . . 0.0 112.236 -173.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -125.87 -32.76 2.78 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.574 1.187 . . . . 0.0 113.633 -178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -66.12 -44.22 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.136 0.88 . . . . 0.0 110.106 175.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 t -61.36 -45.78 92.96 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.239 1.415 . . . . 0.0 111.189 177.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.94 -52.38 56.66 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.478 1.111 . . . . 0.0 113.129 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.98 -24.53 67.75 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -175.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' A' ' 29' ' ' ILE . 12.4 t80 -65.89 -36.67 84.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.459 -0.776 . . . . 0.0 111.606 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -71.34 -28.36 64.02 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.524 1.13 . . . . 0.0 112.007 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.6 mt -66.8 -16.25 64.14 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.89 -12.39 7.54 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -143.13 4.6 1.44 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -171.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t 58.28 -22.24 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 129.435 3.094 . . . . 0.0 118.08 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -77.19 160.56 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.777 -1.202 . . . . 0.0 109.994 165.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.4 m -101.95 103.87 14.53 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.642 0.777 . . . . 0.0 110.645 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.424 ' H ' ' HB3' ' A' ' 21' ' ' TYR 0.401 9.6 tp . . . . . 0 N--CA 1.485 1.32 1 C-N-CA 133.075 4.55 . . . . 0.0 119.463 174.264 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 119.096 -0.478 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -54.92 -35.3 88.99 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.677 2.251 . . . . 0.0 113.961 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.64 -27.29 65.87 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.69 1.132 . . . . 0.0 113.594 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -74.24 -45.64 46.73 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 110.713 168.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.96 -47.68 83.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.244 -0.91 . . . . 0.0 112.963 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.03 -4.25 56.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.699 1.2 . . . . 0.0 113.433 173.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.81 -46.32 7.26 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.875 1.226 . . . . 0.0 111.435 165.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -72.95 -37.39 67.14 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.824 1.25 . . . . 0.0 113.94 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.3 m -139.3 144.78 38.47 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -160.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.93 163.56 13.97 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.161 2.184 . . . . 0.0 112.694 -176.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.49 -144.88 20.83 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.652 1.12 . . . . 0.0 112.085 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -136.18 -37.66 0.71 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.681 1.192 . . . . 0.0 112.371 -172.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.99 -47.57 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.215 1.006 . . . . 0.0 111.455 175.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -72.09 -39.63 68.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.638 0.775 . . . . 0.0 112.191 -174.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -55.6 -47.39 76.57 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.958 0.503 . . . . 0.0 111.045 169.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.31 -29.53 70.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.917 1.287 . . . . 0.0 113.802 174.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -64.2 -40.38 95.96 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.845 -1.159 . . . . 0.0 110.319 175.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.4 t -68.8 -29.95 68.41 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.299 0.639 . . . . 0.0 112.514 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.95 -28.02 69.25 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.087 -1.008 . . . . 0.0 113.458 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -118.62 -29.3 5.45 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -102.76 -15.19 16.35 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.5 1.52 . . . . 0.0 112.626 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.282 8.5 t 51.22 32.12 7.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.121 1.768 . . . . 0.0 114.624 -169.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -131.36 161.32 32.65 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.703 1.601 . . . . 0.0 109.388 168.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 67.6 m -78.47 158.29 28.68 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 161.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.6 tt . . . . . 0 N--CA 1.474 0.767 0 O-C-N 121.039 -1.038 . . . . 0.0 112.418 -174.058 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.6 mmt . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.877 -0.582 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.44 -42.73 45.78 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 122.245 1.963 . . . . 0.0 115.139 -166.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -68.83 -26.48 65.19 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.633 -0.667 . . . . 0.0 112.7 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -88.69 -33.11 17.67 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.416 1.486 . . . . 0.0 112.061 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 94.3 m -57.16 -40.69 77.78 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.116 -0.99 . . . . 0.0 111.325 165.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.22 -1.88 42.5 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 177.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.33 -50.98 2.47 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.292 0.949 . . . . 0.0 112.151 164.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -76.42 -26.58 55.65 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.4 m -118.04 140.79 49.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.552 1.541 . . . . 0.0 111.412 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -114.47 142.68 46.06 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.208 1.403 . . . . 0.0 111.291 -174.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 100.46 -133.7 11.41 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 125.065 1.317 . . . . 0.0 113.462 -171.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.46 -53.1 0.83 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.006 1.322 . . . . 0.0 111.918 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.69 -34.68 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.863 0.865 . . . . 0.0 111.919 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.9 p -63.31 -44.16 95.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.433 1.093 . . . . 0.0 112.469 170.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.94 -43.15 83.95 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.279 1.031 . . . . 0.0 111.062 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.253 0.5 OUTLIER -70.53 -21.58 62.71 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.981 1.264 . . . . 0.0 113.399 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -68.76 -32.71 72.66 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.047 -1.033 . . . . 0.0 111.296 166.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -76.17 -33.05 59.35 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.973 -1.079 . . . . 0.0 111.73 173.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.51 -40.22 96.48 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.258 -0.901 . . . . 0.0 112.681 172.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -91.76 -39.73 11.63 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -128.03 3.72 5.89 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.934 1.294 . . . . 0.0 113.427 -164.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.3 t 63.72 10.96 5.46 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.0 mtm-85 -118.61 169.89 9.42 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.798 1.639 . . . . 0.0 111.4 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 39.6 m -79.52 162.33 25.46 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 157.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.302 16.3 tt . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 123.968 1.842 . . . . 0.0 113.024 -173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.1 mmt . . . . . 0 CA--C 1.543 0.703 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.47 -37.52 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.396 2.73 . . . . 0.0 115.506 -178.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -68.8 -27.29 65.73 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.649 1.58 . . . . 0.0 114.426 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -82.74 -35.63 26.48 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.334 1.054 . . . . 0.0 110.145 173.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.4 m -59.12 -49.62 77.16 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.388 1.075 . . . . 0.0 112.566 174.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.31 5.35 15.01 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 173.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.58 -62.06 1.82 Allowed Glycine 0 CA--C 1.533 1.206 0 O-C-N 121.504 -0.748 . . . . 0.0 111.274 156.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -72.17 -26.78 62.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.055 1.742 . . . . 0.0 115.261 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.0 m -121.82 148.94 44.05 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.868 1.267 . . . . 0.0 112.297 -170.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -121.29 140.32 52.23 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.202 1.801 . . . . 0.0 110.316 -176.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.59 162.74 33.82 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 123.511 0.577 . . . . 0.0 113.159 -170.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -82.47 -39.95 21.8 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.99 1.316 . . . . 0.0 110.689 -164.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.03 -39.12 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 124.861 1.264 . . . . 0.0 111.308 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.5 t -72.15 -43.36 64.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.891 0.769 . . . . 0.0 111.971 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -58.29 -42.69 87.13 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.31 -0.869 . . . . 0.0 111.651 168.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -66.94 -23.86 66.01 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 173.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -69.63 -36.1 75.83 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.18 -1.575 . . . . 0.0 110.654 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.8 t -71.34 -33.1 69.31 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.806 -0.559 . . . . 0.0 111.713 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.25 -39.09 78.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.04 0.837 . . . . 0.0 112.521 174.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -105.45 -26.28 12.0 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -168.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -135.17 5.47 3.28 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.225 1.41 . . . . 0.0 113.092 -171.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.8 m 54.64 28.08 9.49 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 175.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -132.27 166.49 21.77 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.309 1.844 . . . . 0.0 110.88 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 m -70.18 163.62 25.97 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 151.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 11.8 tt . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -169.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 76.4 mtm . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.88 -36.53 98.17 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.033 2.489 . . . . 0.0 113.61 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.18 -27.74 68.91 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.912 1.285 . . . . 0.0 114.115 177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -74.8 -48.74 23.73 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.174 0.99 . . . . 0.0 110.59 166.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 72.6 m -57.69 -43.07 84.86 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.41 -11.35 59.94 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 176.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.55 -41.7 10.99 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.577 1.084 . . . . 0.0 112.65 166.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -76.65 -26.72 55.18 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 118.576 1.188 . . . . 0.0 113.327 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.14 145.95 34.78 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -165.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -118.46 148.81 42.2 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.528 1.931 . . . . 0.0 112.414 -171.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 101.52 -138.46 13.89 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.654 1.121 . . . . 0.0 112.466 -170.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -132.36 -51.55 0.94 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.487 1.915 . . . . 0.0 112.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.9 t -70.73 -31.8 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.599 0.76 . . . . 0.0 111.239 -173.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.4 p -60.34 -53.23 60.08 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.431 1.492 . . . . 0.0 111.877 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -58.39 -47.95 82.21 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.359 1.464 . . . . 0.0 111.587 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.29 -28.38 69.68 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.113 1.765 . . . . 0.0 113.67 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -71.06 -39.05 72.47 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.096 -1.003 . . . . 0.0 110.327 172.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.28 -33.09 74.57 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.347 -0.845 . . . . 0.0 111.803 176.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.1 mt -61.09 -28.74 69.3 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.982 -1.074 . . . . 0.0 113.283 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -103.41 -20.17 14.16 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -148.09 3.15 0.69 Allowed 'General case' 0 CA--C 1.555 1.136 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 -170.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.4 m 56.66 -13.38 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -76.34 172.14 13.39 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.099 1.318 . . . . 0.0 109.887 159.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.6 m -110.72 159.72 17.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.821 0.848 . . . . 0.0 111.252 161.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 16.4 tt . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -170.125 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 50.0 mtt . . . . . 0 CA--C 1.546 0.802 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.206 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.61 -37.24 95.45 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.754 2.303 . . . . 0.0 113.869 -177.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.5 -8.05 55.73 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -84.64 -46.02 11.92 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 163.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.3 m -56.26 -59.65 4.64 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.318 1.047 . . . . 0.0 112.513 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.06 -0.09 26.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.87 -26.02 54.54 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.774 1.178 . . . . 0.0 114.011 169.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -125.57 -22.1 4.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.6 134.48 53.14 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.718 1.145 . . . . 0.0 111.054 -174.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -115.24 143.59 45.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.411 1.484 . . . . 0.0 110.535 -164.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.03 -141.93 15.45 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 124.214 0.912 . . . . 0.0 112.876 -173.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -127.73 -45.87 1.44 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.959 1.304 . . . . 0.0 112.617 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -63.92 -39.07 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 119.374 0.988 . . . . 0.0 112.253 -177.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.9 p -63.8 -48.09 78.25 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.592 1.157 . . . . 0.0 111.983 175.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.56 -52.34 65.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.066 1.346 . . . . 0.0 111.486 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -56.96 -34.32 67.93 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.285 1.834 . . . . 0.0 113.189 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -67.36 -36.81 82.14 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 121.271 -0.893 . . . . 0.0 110.536 173.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.9 t -76.83 -31.55 56.98 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.011 -1.056 . . . . 0.0 112.561 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.63 -34.28 75.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.378 0.99 . . . . 0.0 111.816 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -87.23 -44.43 11.46 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 174.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -118.16 -5.59 10.91 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.815 1.246 . . . . 0.0 114.065 -160.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.0 m 60.84 20.9 11.09 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.884 2.073 . . . . 0.0 115.881 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -137.33 170.49 15.99 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 129.267 3.027 . . . . 0.0 108.018 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -107.38 142.42 37.23 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.87 1.668 . . . . 0.0 112.11 173.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 125.374 1.47 . . . . 0.0 113.212 -169.15 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 39.2 mtt . . . . . 0 CA--C 1.545 0.774 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.06 -34.25 98.86 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.805 1.67 . . . . 0.0 115.442 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -63.58 -41.17 98.4 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.009 1.277 . . . . 0.0 112.91 176.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -63.49 -46.92 83.92 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.973 0.909 . . . . 0.0 110.47 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 85.0 m -67.14 -38.13 85.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.996 0.918 . . . . 0.0 113.243 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.0 -7.13 57.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.34 -44.42 9.62 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 123.65 0.643 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -78.7 -33.97 46.43 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.2 m -113.98 158.44 21.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.914 1.285 . . . . 0.0 112.768 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 -119.83 147.3 44.83 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.284 1.434 . . . . 0.0 110.524 170.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.95 -155.79 20.04 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.89 1.233 . . . . 0.0 111.629 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -129.13 -42.86 1.34 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.431 1.115 . . . . 0.0 112.656 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -64.82 -36.6 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.297 0.953 . . . . 0.0 110.906 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.7 p -59.29 -43.31 92.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.08 0.952 . . . . 0.0 112.49 172.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -65.97 -45.62 81.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.044 1.338 . . . . 0.0 111.006 175.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.04 -33.37 75.58 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.799 1.24 . . . . 0.0 113.66 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -67.93 -38.93 83.49 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.639 -1.288 . . . . 0.0 110.513 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -65.64 -31.48 72.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.404 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.4 mt -57.69 -32.16 67.07 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.716 1.144 . . . . 0.0 112.963 177.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -104.22 -33.13 8.81 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.167 1.787 . . . . 0.0 114.367 -175.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -123.76 -3.47 8.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.639 1.176 . . . . 0.0 113.552 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 79.8 m 57.13 13.77 1.75 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -175.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -115.77 160.24 20.37 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.093 1.757 . . . . 0.0 110.89 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 m -74.9 155.56 37.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 159.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 CA--C 1.542 0.647 0 O-C-N 121.364 -0.835 . . . . 0.0 111.898 -176.995 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 44.0 mtt . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.11 -34.64 79.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.389 1.393 . . . . 0.0 114.5 -170.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -78.26 -14.03 59.61 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -83.9 -42.24 16.56 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.127 0.971 . . . . 0.0 110.513 165.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.5 m -62.57 -41.57 99.01 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.38 -0.825 . . . . 0.0 112.488 177.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.29 -5.45 49.48 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 170.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.18 -31.6 27.98 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.529 1.061 . . . . 0.0 113.178 167.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -106.9 -19.66 13.57 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.3 137.29 54.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.82 1.248 . . . . 0.0 111.049 -175.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -106.18 146.44 30.26 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.859 1.264 . . . . 0.0 110.661 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.0 -143.95 16.98 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 123.954 0.787 . . . . 0.0 112.249 -168.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -139.42 -43.84 0.45 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.612 1.165 . . . . 0.0 113.223 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.2 t -64.11 -37.43 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.657 0.783 . . . . 0.0 110.145 174.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 91.6 p -61.78 -45.43 93.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.976 1.31 . . . . 0.0 112.989 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.95 -48.22 81.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.396 1.479 . . . . 0.0 110.816 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.99 -30.16 70.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.997 1.319 . . . . 0.0 113.549 175.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -69.96 -41.39 74.58 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.088 -1.007 . . . . 0.0 110.199 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.1 t -62.97 -35.35 79.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.295 -0.86 . . . . 0.0 112.606 176.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.79 -38.81 67.76 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.587 0.708 . . . . 0.0 111.968 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -91.51 -53.55 4.27 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.923 1.289 . . . . 0.0 111.624 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -103.86 -1.96 26.99 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.741 1.616 . . . . 0.0 114.574 -162.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.5 m 56.28 30.21 16.3 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.119 1.368 . . . . 0.0 114.486 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -139.2 160.1 40.6 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.061 2.144 . . . . 0.0 111.002 176.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -82.87 137.17 34.36 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 162.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 tt . . . . . 0 N--CA 1.472 0.664 0 O-C-N 122.005 -0.435 . . . . 0.0 111.663 -176.451 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 28.7 mtt . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -56.34 -39.13 93.32 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.609 2.206 . . . . 0.0 113.999 173.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -35.48 79.39 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.118 -0.989 . . . . 0.0 112.648 174.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -76.7 -31.84 57.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.995 0.918 . . . . 0.0 112.08 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.2 m -60.13 -43.87 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.979 -1.076 . . . . 0.0 112.145 168.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.58 -19.47 45.52 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.62 -48.03 77.24 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 121.167 -0.958 . . . . 0.0 111.546 165.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -75.08 -55.55 5.62 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.504 1.122 . . . . 0.0 113.609 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.85 146.41 25.98 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.013 0.925 . . . . 0.0 112.434 -164.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmt-85 -106.41 124.81 50.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.697 1.199 . . . . 0.0 111.795 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.15 -157.61 15.46 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.765 1.174 . . . . 0.0 114.548 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -105.48 -53.41 2.66 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.568 1.547 . . . . 0.0 110.779 -178.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.0 t -63.31 -37.28 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.538 0.735 . . . . 0.0 111.498 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.3 p -69.74 -45.32 68.4 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.363 1.065 . . . . 0.0 112.822 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.47 -49.64 76.77 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.536 1.135 . . . . 0.0 110.857 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -61.16 -28.09 68.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.061 1.344 . . . . 0.0 113.758 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.78 -40.67 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.92 -1.113 . . . . 0.0 110.918 172.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.0 t -67.22 -28.38 68.02 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.426 -0.796 . . . . 0.0 112.211 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.58 -16.67 63.93 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.35 -49.42 2.96 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.873 1.269 . . . . 0.0 113.874 173.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -101.03 -6.45 24.4 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.542 1.537 . . . . 0.0 113.816 -169.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.7 m 58.87 23.39 11.3 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.9 mtm105 -128.84 163.81 24.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.146 2.178 . . . . 0.0 110.431 170.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.3 m -71.91 153.32 41.93 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.762 -0.586 . . . . 0.0 109.927 157.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.3 tt . . . . . 0 N--CA 1.473 0.72 0 C-N-CA 124.492 1.117 . . . . 0.0 113.096 -169.654 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.154 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m -130.32 141.29 50.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.445 1.498 . . . . 0.0 112.25 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 104.2 4.19 44.39 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 126.101 1.81 . . . . 0.0 115.01 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.2 p -169.22 131.95 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.159 1.784 . . . . 0.0 110.11 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mmm -82.76 147.93 56.4 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 123.657 0.783 . . . . 0.0 112.063 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.05 -37.78 79.5 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.558 2.839 . . . . 0.0 115.463 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.58 -31.22 72.14 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.678 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -70.63 -43.53 69.03 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.702 -0.624 . . . . 0.0 110.834 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.6 m -63.06 -59.03 5.36 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.512 0.596 . . . . 0.0 112.243 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.51 -25.06 59.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -172.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.77 64.04 Favored Glycine 0 CA--C 1.537 1.422 0 CA-C-O 118.673 -1.07 . . . . 0.0 115.101 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -132.66 -30.54 1.43 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.2 m -90.36 131.49 36.12 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.725 1.148 . . . . 0.0 111.013 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.91 155.01 39.14 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -165.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.1 -128.2 8.88 Favored Glycine 0 N--CA 1.467 0.705 0 C-N-CA 123.723 0.678 . . . . 0.0 112.429 159.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -137.71 -32.32 0.76 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.463 1.105 . . . . 0.0 113.345 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 68.1 t -70.0 -47.13 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.039 1.336 . . . . 0.0 112.156 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.5 t -63.44 -41.57 98.66 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 121.197 -0.939 . . . . 0.0 111.039 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -56.05 -48.88 75.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.398 0.679 . . . . 0.0 111.436 170.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -65.51 -27.16 68.28 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.103 1.361 . . . . 0.0 113.772 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -69.35 -35.87 76.31 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 120.581 -1.324 . . . . 0.0 110.431 170.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.89 -42.16 58.36 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.566 -0.709 . . . . 0.0 110.626 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.72 -42.25 96.88 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.939 -1.101 . . . . 0.0 112.443 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 mtmm -78.54 -38.45 40.48 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.73 1.88 1.19 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -156.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.25 86.0 m 56.12 41.39 29.57 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.276 2.231 . . . . 0.0 116.355 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -129.83 158.75 38.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.696 1.599 . . . . 0.0 110.457 169.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.7 m -116.18 139.0 50.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 122.341 1.067 . . . . 0.0 111.881 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 tt -80.63 157.84 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 125.954 1.701 . . . . 0.0 112.844 -165.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.179 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.1 p -129.75 10.44 5.56 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.382 1.473 . . . . 0.0 114.611 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.81 162.06 10.7 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.105 1.336 . . . . 0.0 113.263 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 12.9 m -78.15 54.01 1.29 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.863 1.665 . . . . 0.0 112.427 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 64.4 mtm -82.65 145.25 50.4 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.726 1.61 . . . . 0.0 111.292 -174.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.87 -31.93 96.31 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.195 1.93 . . . . 0.0 114.939 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.9 -20.73 62.47 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 114.708 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -85.37 -46.3 11.08 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.968 1.707 . . . . 0.0 110.224 168.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.2 m -59.95 -48.98 79.5 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.652 0.781 . . . . 0.0 112.989 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.15 -10.16 59.5 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 173.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.46 -33.31 39.45 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.84 1.209 . . . . 0.0 113.175 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -98.02 -19.64 17.88 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.1 m -130.73 145.03 51.84 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.435 1.094 . . . . 0.0 112.687 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 mmp_? -99.45 162.22 13.16 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.38 2.272 . . . . 0.0 110.561 169.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 94.99 -145.27 17.64 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-O 118.974 -0.903 . . . . 0.0 112.101 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -140.7 -53.4 0.49 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.106 1.453 . . . . 0.0 114.724 -169.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -70.63 -32.53 49.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.818 0.847 . . . . 0.0 110.436 175.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.0 p -54.12 -54.74 35.46 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 125.97 1.708 . . . . 0.0 111.854 168.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -62.86 -42.14 99.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.628 1.171 . . . . 0.0 111.92 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.69 -28.47 60.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -175.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -65.77 -30.57 71.24 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.159 -1.588 . . . . 0.0 110.197 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.0 t -70.22 -25.58 63.46 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.657 -0.652 . . . . 0.0 111.689 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 mt -75.38 -29.45 59.86 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.7 -32.9 11.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.045 0.938 . . . . 0.0 113.359 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -137.91 10.37 2.85 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.946 1.299 . . . . 0.0 113.755 -162.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.0 m 63.43 7.45 2.98 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.893 2.553 . . . . 0.0 117.893 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.6 mtm105 -131.87 159.97 37.06 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.26 1.424 . . . . 0.0 111.645 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 m -78.54 159.01 28.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 118.257 0.481 . . . . 0.0 110.236 158.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 15.2 tt -86.46 60.53 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 123.522 1.629 . . . . 0.0 114.653 -156.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 128.307 2.643 . . . . 0.0 112.516 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.1 t -54.66 130.92 42.1 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.621 1.168 . . . . 0.0 112.883 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.15 3.59 72.66 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 164.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.9 m -134.04 62.42 1.65 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.52 1.528 . . . . 0.0 111.371 -169.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.76 154.66 88.3 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.052 1.341 . . . . 0.0 112.854 -178.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.33 -40.67 65.96 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.36 2.04 . . . . 0.0 113.611 -178.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -69.42 -7.04 34.19 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 174.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -96.68 -43.58 7.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 111.074 166.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 89.6 m -61.37 -30.9 70.82 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.853 -1.155 . . . . 0.0 113.661 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.76 -5.06 54.56 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.54 -27.34 15.16 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.738 1.161 . . . . 0.0 113.477 163.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -88.05 -28.84 21.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 60.5 m -131.43 149.9 52.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.631 1.173 . . . . 0.0 112.873 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -110.81 135.16 51.8 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.311 1.444 . . . . 0.0 110.715 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.34 -145.07 18.63 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.258 1.409 . . . . 0.0 112.713 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -137.99 -44.77 0.52 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.073 1.349 . . . . 0.0 112.911 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.85 -41.0 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.359 1.064 . . . . 0.0 109.978 170.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -59.79 -43.26 94.51 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.88 0.872 . . . . 0.0 112.419 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.16 -27.51 68.07 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.672 1.189 . . . . 0.0 113.756 175.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -78.75 -36.16 43.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.584 1.083 . . . . 0.0 113.28 167.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.05 -43.92 95.04 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.416 -1.428 . . . . 0.0 111.03 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.8 t -58.37 -27.2 63.99 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.558 1.143 . . . . 0.0 113.642 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -62.4 -29.04 70.2 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.908 1.231 . . . . 0.0 113.563 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -111.0 -38.74 4.99 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.131 0.972 . . . . 0.0 113.054 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -92.58 -22.66 19.38 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -171.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.7 m 55.8 21.43 4.74 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.703 1.601 . . . . 0.0 115.091 -173.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -117.09 170.7 8.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.733 2.013 . . . . 0.0 109.485 161.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 m -77.31 174.1 11.16 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 155.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.263 14.4 tt -65.34 96.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 O-C-N 120.774 -1.204 . . . . 0.0 113.904 -167.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 128.046 2.538 . . . . 0.0 111.65 172.336 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.117 0 N-CA-C 110.181 -1.167 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.9 m -123.91 12.96 9.13 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.717 1.207 . . . . 0.0 113.73 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.16 146.83 28.03 Favored Glycine 0 CA--C 1.534 1.245 0 O-C-N 121.408 -0.808 . . . . 0.0 112.591 173.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 p -137.99 31.83 2.44 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -171.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 60.0 mtm -70.91 147.44 94.05 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.457 0.703 . . . . 0.0 110.429 159.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.83 -44.24 50.93 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.514 2.809 . . . . 0.0 115.078 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pm0 -74.63 -8.54 56.69 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -91.88 -42.1 10.24 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.734 1.614 . . . . 0.0 110.482 167.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 93.8 m -59.64 -46.32 89.36 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.183 0.993 . . . . 0.0 112.138 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -16.16 61.89 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.07 -27.55 70.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.727 -1.041 . . . . 0.0 113.135 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -104.46 -35.7 7.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.775 1.768 . . . . 0.0 115.775 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.1 m -106.1 146.61 29.96 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.015 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -117.82 137.53 52.7 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.957 1.303 . . . . 0.0 111.504 -171.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.15 -156.53 25.26 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 123.725 0.678 . . . . 0.0 111.946 -161.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -116.49 -46.94 2.75 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 0.0 112.216 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.99 -35.79 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.735 0.814 . . . . 0.0 110.964 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.6 p -66.09 -45.17 82.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.786 1.234 . . . . 0.0 112.752 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -63.63 -43.5 96.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.217 1.007 . . . . 0.0 110.461 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.07 -29.16 70.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.363 1.065 . . . . 0.0 113.437 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -70.87 -37.13 73.05 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.147 -0.971 . . . . 0.0 110.356 175.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 37.2 t -64.42 -34.59 78.53 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.96 -1.088 . . . . 0.0 111.374 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.72 -34.81 73.39 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -119.72 2.1 11.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.196 1.398 . . . . 0.0 114.012 -168.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -145.17 -15.27 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.909 1.283 . . . . 0.0 114.121 -177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.0 m 58.76 37.78 24.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.902 1.281 . . . . 0.0 114.032 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 54.1 mtp85 -141.76 161.52 37.75 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.64 2.376 . . . . 0.0 110.327 171.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -86.11 135.53 33.57 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.807 0.73 . . . . 0.0 110.122 164.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 2.7 tt -64.77 131.86 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 O-C-N 121.261 -0.899 . . . . 0.0 110.165 173.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.591 0.756 . . . . 0.0 112.504 -174.659 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.975 0 CA-C-O 119.073 -0.849 . . . . 0.0 111.381 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -131.89 165.76 23.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.998 2.119 . . . . 0.0 110.845 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.07 -146.22 25.11 Favored Glycine 0 N--CA 1.47 0.946 0 O-C-N 121.431 -0.793 . . . . 0.0 111.52 -169.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 78.7 m -74.95 48.45 0.39 Allowed 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.654 -1.498 . . . . 0.0 113.77 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 52.9 mtt -110.88 150.34 41.7 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.418 1.887 . . . . 0.0 113.089 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.71 -35.88 94.0 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.548 2.832 . . . . 0.0 115.755 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -71.95 -36.47 69.89 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.459 0.704 . . . . 0.0 111.944 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.22 -37.2 77.9 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.595 -0.69 . . . . 0.0 111.152 175.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.8 m -61.7 -54.68 39.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.484 0.714 . . . . 0.0 111.603 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.66 60.29 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.67 2.48 39.72 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.803 1.192 . . . . 0.0 115.731 172.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -143.34 -39.15 0.32 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.291 1.545 . . . . 0.0 114.259 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 83.0 m -94.67 141.56 28.47 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.167 0.987 . . . . 0.0 111.222 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -104.11 159.24 15.84 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 112.731 -164.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.05 -135.03 12.83 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.503 1.525 . . . . 0.0 113.711 175.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.1 tttp -132.76 -45.47 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.349 1.46 . . . . 0.0 112.912 174.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -61.82 -39.93 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.038 0.835 . . . . 0.0 112.087 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.1 t -76.61 -38.85 54.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.632 0.773 . . . . 0.0 112.316 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -56.71 -50.66 71.5 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.429 -0.794 . . . . 0.0 111.189 168.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -58.86 -29.25 66.82 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.945 1.698 . . . . 0.0 113.212 173.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -68.33 -43.34 77.76 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.082 -1.011 . . . . 0.0 110.862 174.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.39 -26.58 66.52 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -62.75 -26.68 68.82 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 120.973 -1.079 . . . . 0.0 113.612 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -102.56 -38.34 7.57 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.921 1.289 . . . . 0.0 113.605 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -118.51 -14.0 9.69 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -161.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.8 t 56.66 -11.75 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.588 2.355 . . . . 0.0 116.979 -172.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -75.16 167.27 22.24 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.758 -1.214 . . . . 0.0 109.489 151.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.0 m -98.86 164.02 12.37 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.262 1.025 . . . . 0.0 109.937 159.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 tt -70.39 108.95 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 O-C-N 121.245 -0.909 . . . . 0.0 113.442 -163.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 125.528 1.531 . . . . 0.0 114.193 -164.81 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.268 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -73.53 63.88 0.84 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.411 1.884 . . . . 0.0 111.609 173.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.87 -176.13 50.64 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 123.745 0.688 . . . . 0.0 111.911 -152.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 12.5 m 53.49 79.37 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.127 1.771 . . . . 0.0 110.856 -171.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 21.2 mmt -94.72 159.22 33.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.448 1.499 . . . . 0.0 112.161 -172.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -58.54 -35.91 98.05 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.038 1.825 . . . . 0.0 114.496 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -34.49 74.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.287 1.035 . . . . 0.0 113.442 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.14 -48.87 18.98 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.085 1.354 . . . . 0.0 110.756 170.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.1 m -63.87 -39.44 94.21 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.5 53.15 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 174.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.68 -23.96 24.61 Favored Glycine 0 CA--C 1.538 1.528 0 C-N-CA 125.093 1.33 . . . . 0.0 113.456 165.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -81.44 -42.85 19.75 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.504 1.122 . . . . 0.0 112.745 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 91.1 m -135.88 147.81 48.35 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.518 1.127 . . . . 0.0 113.41 -162.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -114.89 147.88 39.35 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.916 1.687 . . . . 0.0 110.415 -169.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.51 -142.44 16.16 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 -164.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.05 -43.01 0.26 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.581 1.191 . . . . 0.0 113.646 -178.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.55 -37.6 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.421 0.688 . . . . 0.0 110.964 172.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.2 p -61.55 -44.65 96.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.943 1.297 . . . . 0.0 112.388 172.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.07 -48.46 78.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.821 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.39 -33.35 71.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.352 1.461 . . . . 0.0 112.904 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.99 -40.52 91.27 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.933 -1.104 . . . . 0.0 110.608 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.2 t -65.38 -35.57 81.36 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.562 0.745 . . . . 0.0 112.835 173.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.12 -36.17 67.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.577 1.08 . . . . 0.0 112.338 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -99.54 -35.87 9.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.988 1.315 . . . . 0.0 113.952 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -126.81 -1.3 6.65 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.415 1.086 . . . . 0.0 113.508 -166.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 58.58 -22.62 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 129.001 2.92 . . . . 0.0 117.84 -175.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -69.88 174.2 5.52 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.012 1.725 . . . . 0.0 109.837 163.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.74 158.55 19.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 111.03 161.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.6 tt -58.32 146.62 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.05 1.34 . . . . 0.0 113.622 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 . . . . . 0 C--O 1.248 1.003 0 C-N-CA 126.091 1.756 . . . . 0.0 111.211 174.683 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -129.9 162.55 28.32 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.202 1.401 . . . . 0.0 112.777 -170.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.95 -127.88 9.24 Favored Glycine 0 N--CA 1.474 1.192 0 O-C-N 121.43 -0.793 . . . . 0.0 114.05 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.7 m -85.34 21.94 1.62 Allowed 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.704 1.252 . . . . 0.0 113.613 175.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 87.6 mtp -79.01 136.05 58.16 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 124.061 0.944 . . . . 0.0 110.749 176.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -53.03 -42.55 63.78 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.632 2.888 . . . . 0.0 114.886 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.68 -27.91 69.57 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.74 1.216 . . . . 0.0 113.986 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -80.92 -38.03 28.57 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 111.687 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.7 m -54.1 -48.05 71.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.317 0.647 . . . . 0.0 111.145 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.09 -27.91 61.12 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.6 -38.41 78.37 Favored Glycine 0 CA--C 1.536 1.346 0 O-C-N 121.346 -0.847 . . . . 0.0 113.573 173.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -85.06 -28.32 25.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.635 1.174 . . . . 0.0 113.716 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.1 m -126.61 138.96 53.51 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.396 0.998 . . . . 0.0 113.095 -166.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -98.56 137.28 37.45 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.021 1.728 . . . . 0.0 111.998 -170.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.14 -139.51 14.58 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.221 0.915 . . . . 0.0 112.416 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -136.88 -51.72 0.68 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.795 1.638 . . . . 0.0 112.819 -174.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.35 -38.51 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 0.0 110.827 174.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 86.5 p -58.51 -45.6 88.46 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.937 0.895 . . . . 0.0 112.512 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -62.91 -51.09 68.32 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.567 1.547 . . . . 0.0 110.553 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.62 -26.41 68.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.405 1.482 . . . . 0.0 113.801 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -62.99 -42.93 99.98 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.566 -1.334 . . . . 0.0 110.333 170.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -70.58 -33.12 70.73 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 111.629 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.23 -29.7 68.93 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mtmm -112.3 -22.33 10.96 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -130.94 -9.05 3.91 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.959 1.304 . . . . 0.0 113.557 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.284 7.8 t 47.57 40.06 10.87 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.512 1.925 . . . . 0.0 114.405 -172.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -136.03 159.9 40.28 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.615 2.366 . . . . 0.0 109.371 164.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.44 147.9 24.26 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.488 0.585 . . . . 0.0 111.13 163.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.4 tt -69.36 120.95 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 124.937 1.295 . . . . 0.0 111.52 -167.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 C--O 1.253 1.259 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -173.041 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.997 0 CA-C-O 119.818 -0.434 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.1 p -149.77 -12.42 0.28 Allowed 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 164.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.98 -179.21 38.82 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.631 1.586 . . . . 0.0 112.776 169.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 56.5 m -78.46 63.17 3.25 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.269 1.027 . . . . 0.0 112.785 -173.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mtp -96.3 145.02 28.84 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 126.734 2.013 . . . . 0.0 111.556 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.04 -39.35 91.73 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.587 2.192 . . . . 0.0 114.564 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.47 -25.97 64.34 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -71.39 -45.07 63.71 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.121 -0.987 . . . . 0.0 110.705 170.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 81.0 m -58.06 -49.74 75.87 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.403 0.681 . . . . 0.0 112.528 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.71 -22.22 43.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.23 -28.69 72.46 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 118.748 -1.029 . . . . 0.0 113.518 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -103.44 -37.41 7.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.184 1.492 . . . . 0.0 114.371 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.47 144.29 37.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.181 1.355 . . . . 0.0 113.288 -169.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -113.56 137.47 51.52 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.056 1.342 . . . . 0.0 111.089 -165.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.08 -160.97 17.53 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.056 0.836 . . . . 0.0 112.695 -168.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -114.69 -44.13 3.09 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.665 1.586 . . . . 0.0 111.146 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.93 -38.78 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.485 0.714 . . . . 0.0 111.556 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -63.62 -48.01 79.02 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.224 1.409 . . . . 0.0 112.194 176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.32 -46.91 86.61 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.872 1.269 . . . . 0.0 111.333 175.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.44 -23.2 64.58 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.841 0.856 . . . . 0.0 113.023 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.32 -36.26 83.51 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.471 -1.393 . . . . 0.0 109.953 168.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.47 -35.3 46.84 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.461 -0.774 . . . . 0.0 112.088 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -59.16 -40.13 84.62 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.03 0.832 . . . . 0.0 112.02 173.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -93.6 -30.87 14.74 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -139.8 3.94 2.08 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -164.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.281 4.3 t 50.83 19.18 0.59 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 128.025 2.53 . . . . 0.0 117.215 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.1 mmt-85 -111.48 168.46 9.53 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.475 1.51 . . . . 0.0 109.181 163.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -99.07 160.98 13.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.496 0.665 . . . . 0.0 111.122 163.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 14.7 tt -69.68 128.92 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.643 -0.66 . . . . 0.0 111.061 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.3 mtm180 . . . . . 0 C--O 1.252 1.23 0 C-N-CA 127.8 2.44 . . . . 0.0 109.355 -179.489 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.099 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -136.02 19.34 3.23 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.969 1.307 . . . . 0.0 114.317 177.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.08 145.41 4.53 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.343 1.449 . . . . 0.0 112.14 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 79.5 m -118.3 8.13 12.17 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -174.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 mmt -70.06 143.41 91.47 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.361 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -55.61 -40.47 85.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.404 2.736 . . . . 0.0 116.32 -171.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -72.11 -29.12 63.77 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.465 1.106 . . . . 0.0 112.527 175.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -81.63 -29.74 33.11 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.056 1.343 . . . . 0.0 112.109 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 92.2 m -57.09 -42.87 81.53 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.079 -1.013 . . . . 0.0 110.546 164.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.03 -2.81 38.96 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -50.73 3.91 Favored Glycine 0 CA--C 1.534 1.235 0 O-C-N 121.314 -0.866 . . . . 0.0 111.61 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.45 -33.29 74.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.721 0.808 . . . . 0.0 113.054 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.4 m -136.87 144.1 43.39 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 0.0 112.641 -165.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -132.11 142.31 49.46 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.306 -0.871 . . . . 0.0 112.42 -168.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.18 -152.71 18.0 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.539 1.542 . . . . 0.0 111.323 -165.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -118.9 -45.41 2.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.932 1.693 . . . . 0.0 112.019 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.14 -36.42 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.185 1.394 . . . . 0.0 111.143 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 64.4 p -57.97 -45.83 86.1 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.118 0.967 . . . . 0.0 111.856 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -66.21 -47.73 72.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.316 1.046 . . . . 0.0 111.821 174.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -57.93 -32.16 67.52 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.185 1.394 . . . . 0.0 114.07 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.03 -34.07 74.63 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.928 174.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 48.1 t -77.56 -29.22 52.05 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.081 -1.012 . . . . 0.0 111.931 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.69 -38.69 91.4 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -98.96 -28.19 13.53 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -173.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -139.94 -1.43 1.59 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -166.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t 44.21 57.93 4.01 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.573 1.549 . . . . 0.0 113.334 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -139.78 167.66 21.6 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.918 2.887 . . . . 0.0 108.696 170.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.4 m -128.33 144.99 51.2 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.395 0.678 . . . . 0.0 111.312 170.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -83.7 133.92 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.425 0.69 . . . . 0.0 112.826 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--O 1.248 1.0 0 C-N-CA 127.674 2.389 . . . . 0.0 111.731 178.115 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.954 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -142.81 171.79 13.57 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 0.0 111.928 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.77 -122.01 6.92 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 121.493 -0.754 . . . . 0.0 113.447 172.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 30.49 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 126.767 2.027 . . . . 0.0 116.309 -174.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 59.7 mtt -112.61 144.13 30.34 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 127.947 2.499 . . . . 0.0 111.922 -176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.6 -38.78 92.45 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.418 2.078 . . . . 0.0 115.079 -169.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -68.68 -30.61 69.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 114.286 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -82.52 -33.42 28.25 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.081 0.855 . . . . 0.0 110.792 173.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.2 m -65.49 -31.47 72.56 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.054 0.942 . . . . 0.0 113.27 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.43 17.0 19.94 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.232 1.413 . . . . 0.0 114.07 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.86 -40.09 85.05 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.767 1.175 . . . . 0.0 113.597 173.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -128.08 7.04 6.0 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.04 1.736 . . . . 0.0 113.637 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.2 m -137.12 139.24 41.07 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.711 1.604 . . . . 0.0 112.012 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -111.79 174.39 5.9 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.577 1.951 . . . . 0.0 111.641 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 -158.49 39.48 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.425 1.012 . . . . 0.0 113.357 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -113.42 -46.37 3.07 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.767 1.627 . . . . 0.0 111.518 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.3 t -60.92 -45.18 98.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 118.795 0.725 . . . . 0.0 111.771 -171.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -80.09 -38.28 32.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.171 0.588 . . . . 0.0 112.121 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -59.12 -48.39 81.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.41 -0.806 . . . . 0.0 112.065 170.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -22.97 61.51 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.48 1.037 . . . . 0.0 113.345 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.45 ' CD2' ' HA ' ' A' ' 29' ' ' ILE . 23.9 t80 -60.97 -43.67 98.46 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.51 -0.744 . . . . 0.0 109.3 168.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -69.06 -31.11 69.64 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.304 -0.873 . . . . 0.0 112.943 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.06 -24.68 67.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 120.029 1.286 . . . . 0.0 113.348 174.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -99.97 -43.7 6.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.837 1.255 . . . . 0.0 113.144 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -114.7 -7.39 12.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.423 1.889 . . . . 0.0 114.203 -161.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m 62.18 9.56 3.25 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.089 2.156 . . . . 0.0 116.473 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.0 mtm105 -119.9 162.33 19.35 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 0.0 110.61 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.8 m -81.72 147.26 29.56 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.345 0.658 . . . . 0.0 109.779 160.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.45 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 14.4 tt -58.42 -29.48 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 117.256 2.317 . . . . 0.0 117.256 -151.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.363 1.616 . . . . 0.0 115.363 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.7 m -66.18 -21.38 66.32 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -173.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -160.23 146.01 12.01 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.94 1.257 . . . . 0.0 110.961 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 14.2 m -134.05 20.6 3.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.408 1.483 . . . . 0.0 113.525 -158.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt -104.65 151.93 39.36 Favored Pre-proline 0 CA--C 1.54 0.591 0 C-N-CA 126.208 1.803 . . . . 0.0 111.256 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -61.34 -35.31 84.63 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 121.68 1.587 . . . . 0.0 115.001 -166.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -77.01 -21.73 54.18 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.421 1.488 . . . . 0.0 113.922 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -81.17 -42.26 21.12 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.229 1.412 . . . . 0.0 109.97 170.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 84.5 m -58.77 -43.35 90.37 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.302 -0.874 . . . . 0.0 112.724 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.96 -12.61 59.97 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.24 -39.28 32.02 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 118.525 0.602 . . . . 0.0 113.136 168.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -94.37 -24.45 17.37 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.9 m -112.59 135.41 53.34 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.026 0.93 . . . . 0.0 112.328 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -104.33 148.53 26.28 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.689 . . . . 0.0 110.508 171.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.67 -160.96 28.09 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.6 1.095 . . . . 0.0 111.929 -162.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -125.8 -45.57 1.75 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.865 1.666 . . . . 0.0 112.206 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.21 -38.45 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 118.985 0.812 . . . . 0.0 110.85 173.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -66.34 -46.43 76.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.68 1.592 . . . . 0.0 112.813 176.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -61.52 -43.6 98.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.375 1.07 . . . . 0.0 110.357 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.04 -28.22 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.703 1.201 . . . . 0.0 113.385 174.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.62 -33.23 72.36 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.071 173.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.76 -33.52 66.39 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.689 -1.257 . . . . 0.0 111.633 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.0 mt -59.23 -38.81 80.89 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.882 0.765 . . . . 0.0 112.533 173.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.7 mtmm -102.02 -23.17 14.13 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -136.93 -5.34 1.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -170.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t 53.06 41.89 32.19 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -134.06 161.45 34.82 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.109 1.764 . . . . 0.0 109.631 163.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.1 m -84.41 141.66 30.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 153.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.2 tt -66.89 125.48 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.278 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 . . . . . 0 N--CA 1.486 1.335 0 C-N-CA 125.012 1.325 . . . . 0.0 113.357 172.958 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.776 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -74.11 166.09 24.01 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.568 1.547 . . . . 0.0 113.744 -177.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.7 152.08 28.47 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.157 0.884 . . . . 0.0 113.993 175.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.3 m -119.83 19.83 12.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.247 1.419 . . . . 0.0 113.83 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.6 mmt -104.09 155.59 36.93 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 125.887 1.675 . . . . 0.0 112.101 -174.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.64 -34.42 92.22 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.367 2.044 . . . . 0.0 115.119 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -72.04 -21.67 61.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.235 1.414 . . . . 0.0 114.399 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 -45.75 17.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.385 0.674 . . . . 0.0 109.886 169.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 70.5 m -56.95 -52.03 66.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.922 0.889 . . . . 0.0 111.92 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.8 -21.06 44.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.39 -22.93 78.57 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.916 171.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -116.32 -10.71 11.34 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.811 1.306 . . . . 0.0 114.498 -176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 m -138.35 134.81 34.68 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.695 1.198 . . . . 0.0 111.171 -173.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -99.91 156.34 17.19 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.255 1.422 . . . . 0.0 112.518 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.86 -153.09 29.33 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.292 1.425 . . . . 0.0 112.236 -173.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -125.87 -32.76 2.78 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.574 1.187 . . . . 0.0 113.633 -178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -66.12 -44.22 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.136 0.88 . . . . 0.0 110.106 175.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 t -61.36 -45.78 92.96 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.239 1.415 . . . . 0.0 111.189 177.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.94 -52.38 56.66 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.478 1.111 . . . . 0.0 113.129 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.98 -24.53 67.75 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -175.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' A' ' 29' ' ' ILE . 12.4 t80 -65.89 -36.67 84.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.459 -0.776 . . . . 0.0 111.606 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -71.34 -28.36 64.02 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.524 1.13 . . . . 0.0 112.007 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.6 mt -66.8 -16.25 64.14 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.89 -12.39 7.54 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -143.13 4.6 1.44 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -171.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t 58.28 -22.24 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 129.435 3.094 . . . . 0.0 118.08 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -77.19 160.56 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.777 -1.202 . . . . 0.0 109.994 165.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.4 m -101.95 103.87 14.53 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.642 0.777 . . . . 0.0 110.645 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.424 ' H ' ' HB3' ' A' ' 21' ' ' TYR 0.401 9.6 tp 49.52 -23.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 1 C-N-CA 133.075 4.55 . . . . 0.0 119.463 174.264 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.7 1.6 . . . . 0.0 112.774 -176.179 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.201 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.1 m -114.81 169.82 8.79 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.462 1.505 . . . . 0.0 114.285 -170.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -47.66 115.31 2.15 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.52 1.533 . . . . 0.0 116.713 -167.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.0 m 53.53 18.21 1.35 Allowed 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 116.512 2.042 . . . . 0.0 116.512 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 61.0 mtt -83.4 156.36 65.87 Favored Pre-proline 0 N--CA 1.471 0.594 0 C-N-CA 124.543 1.137 . . . . 0.0 110.84 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -54.92 -35.3 88.99 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.677 2.251 . . . . 0.0 113.961 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.64 -27.29 65.87 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.69 1.132 . . . . 0.0 113.594 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -74.24 -45.64 46.73 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 110.713 168.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.96 -47.68 83.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.244 -0.91 . . . . 0.0 112.963 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.03 -4.25 56.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.699 1.2 . . . . 0.0 113.433 173.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.81 -46.32 7.26 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.875 1.226 . . . . 0.0 111.435 165.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -72.95 -37.39 67.14 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.824 1.25 . . . . 0.0 113.94 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.3 m -139.3 144.78 38.47 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -160.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.93 163.56 13.97 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.161 2.184 . . . . 0.0 112.694 -176.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.49 -144.88 20.83 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.652 1.12 . . . . 0.0 112.085 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -136.18 -37.66 0.71 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.681 1.192 . . . . 0.0 112.371 -172.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.99 -47.57 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.215 1.006 . . . . 0.0 111.455 175.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -72.09 -39.63 68.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.638 0.775 . . . . 0.0 112.191 -174.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -55.6 -47.39 76.57 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.958 0.503 . . . . 0.0 111.045 169.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.31 -29.53 70.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.917 1.287 . . . . 0.0 113.802 174.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -64.2 -40.38 95.96 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.845 -1.159 . . . . 0.0 110.319 175.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.4 t -68.8 -29.95 68.41 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.299 0.639 . . . . 0.0 112.514 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.95 -28.02 69.25 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.087 -1.008 . . . . 0.0 113.458 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -118.62 -29.3 5.45 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -102.76 -15.19 16.35 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.5 1.52 . . . . 0.0 112.626 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.282 8.5 t 51.22 32.12 7.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.121 1.768 . . . . 0.0 114.624 -169.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -131.36 161.32 32.65 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.703 1.601 . . . . 0.0 109.388 168.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 67.6 m -78.47 158.29 28.68 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 161.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.6 tt -71.59 98.2 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 121.039 -1.038 . . . . 0.0 112.418 -174.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 . . . . . 0 N--CA 1.474 0.734 0 C-N-CA 126.961 2.104 . . . . 0.0 111.872 178.2 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.6 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -96.08 -19.46 19.4 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.127 0.971 . . . . 0.0 112.468 164.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.4 127.55 9.07 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.173 0.892 . . . . 0.0 113.209 176.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.3 p -151.76 44.6 0.76 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.249 1.42 . . . . 0.0 112.61 172.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 154.06 92.49 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.777 0.831 . . . . 0.0 111.285 161.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.44 -42.73 45.78 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 122.245 1.963 . . . . 0.0 115.139 -166.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -68.83 -26.48 65.19 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.633 -0.667 . . . . 0.0 112.7 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -88.69 -33.11 17.67 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.416 1.486 . . . . 0.0 112.061 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 94.3 m -57.16 -40.69 77.78 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.116 -0.99 . . . . 0.0 111.325 165.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.22 -1.88 42.5 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 177.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.33 -50.98 2.47 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.292 0.949 . . . . 0.0 112.151 164.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -76.42 -26.58 55.65 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.4 m -118.04 140.79 49.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.552 1.541 . . . . 0.0 111.412 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -114.47 142.68 46.06 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.208 1.403 . . . . 0.0 111.291 -174.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 100.46 -133.7 11.41 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 125.065 1.317 . . . . 0.0 113.462 -171.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.46 -53.1 0.83 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.006 1.322 . . . . 0.0 111.918 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.69 -34.68 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.863 0.865 . . . . 0.0 111.919 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.9 p -63.31 -44.16 95.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.433 1.093 . . . . 0.0 112.469 170.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.94 -43.15 83.95 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.279 1.031 . . . . 0.0 111.062 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.253 0.5 OUTLIER -70.53 -21.58 62.71 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.981 1.264 . . . . 0.0 113.399 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -68.76 -32.71 72.66 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.047 -1.033 . . . . 0.0 111.296 166.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -76.17 -33.05 59.35 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.973 -1.079 . . . . 0.0 111.73 173.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.51 -40.22 96.48 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.258 -0.901 . . . . 0.0 112.681 172.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -91.76 -39.73 11.63 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -128.03 3.72 5.89 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.934 1.294 . . . . 0.0 113.427 -164.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.3 t 63.72 10.96 5.46 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.0 mtm-85 -118.61 169.89 9.42 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.798 1.639 . . . . 0.0 111.4 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 39.6 m -79.52 162.33 25.46 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 157.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.302 16.3 tt -81.41 78.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-O 123.968 1.842 . . . . 0.0 113.024 -173.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.008 2.123 . . . . 0.0 108.661 168.32 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.154 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -78.44 163.3 25.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.218 1.807 . . . . 0.0 112.779 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.2 -157.74 14.81 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 125.466 1.508 . . . . 0.0 111.699 -174.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 57.45 3.6 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.599 -1.53 . . . . 0.0 111.345 173.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.1 mmt -111.37 141.91 25.39 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 111.499 -170.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.47 -37.52 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.396 2.73 . . . . 0.0 115.506 -178.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -68.8 -27.29 65.73 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.649 1.58 . . . . 0.0 114.426 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -82.74 -35.63 26.48 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.334 1.054 . . . . 0.0 110.145 173.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.4 m -59.12 -49.62 77.16 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.388 1.075 . . . . 0.0 112.566 174.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.31 5.35 15.01 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 173.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.58 -62.06 1.82 Allowed Glycine 0 CA--C 1.533 1.206 0 O-C-N 121.504 -0.748 . . . . 0.0 111.274 156.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -72.17 -26.78 62.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.055 1.742 . . . . 0.0 115.261 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.0 m -121.82 148.94 44.05 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.868 1.267 . . . . 0.0 112.297 -170.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -121.29 140.32 52.23 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.202 1.801 . . . . 0.0 110.316 -176.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.59 162.74 33.82 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 123.511 0.577 . . . . 0.0 113.159 -170.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -82.47 -39.95 21.8 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.99 1.316 . . . . 0.0 110.689 -164.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.03 -39.12 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 124.861 1.264 . . . . 0.0 111.308 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.5 t -72.15 -43.36 64.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.891 0.769 . . . . 0.0 111.971 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -58.29 -42.69 87.13 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.31 -0.869 . . . . 0.0 111.651 168.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -66.94 -23.86 66.01 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 173.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -69.63 -36.1 75.83 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.18 -1.575 . . . . 0.0 110.654 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.8 t -71.34 -33.1 69.31 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.806 -0.559 . . . . 0.0 111.713 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.25 -39.09 78.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.04 0.837 . . . . 0.0 112.521 174.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -105.45 -26.28 12.0 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -168.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -135.17 5.47 3.28 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.225 1.41 . . . . 0.0 113.092 -171.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.8 m 54.64 28.08 9.49 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 175.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -132.27 166.49 21.77 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.309 1.844 . . . . 0.0 110.88 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 m -70.18 163.62 25.97 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 151.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 11.8 tt -58.34 97.05 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -169.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 . . . . . 0 C--O 1.25 1.13 0 C-N-CA 128.01 2.524 . . . . 0.0 111.252 -173.777 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.263 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 p -68.84 108.3 3.4 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.002 0.906 . . . . 0.0 110.219 170.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.6 8.29 62.47 Favored Glycine 0 CA--C 1.534 1.256 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.5 p -152.2 117.09 5.14 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.035 1.334 . . . . 0.0 112.243 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 76.4 mtm -84.34 157.32 62.13 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.733 1.213 . . . . 0.0 112.822 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.88 -36.53 98.17 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.033 2.489 . . . . 0.0 113.61 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.18 -27.74 68.91 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.912 1.285 . . . . 0.0 114.115 177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -74.8 -48.74 23.73 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.174 0.99 . . . . 0.0 110.59 166.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 72.6 m -57.69 -43.07 84.86 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.41 -11.35 59.94 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 176.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.55 -41.7 10.99 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.577 1.084 . . . . 0.0 112.65 166.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -76.65 -26.72 55.18 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 118.576 1.188 . . . . 0.0 113.327 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.14 145.95 34.78 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -165.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -118.46 148.81 42.2 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.528 1.931 . . . . 0.0 112.414 -171.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 101.52 -138.46 13.89 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.654 1.121 . . . . 0.0 112.466 -170.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -132.36 -51.55 0.94 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.487 1.915 . . . . 0.0 112.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.9 t -70.73 -31.8 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.599 0.76 . . . . 0.0 111.239 -173.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.4 p -60.34 -53.23 60.08 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.431 1.492 . . . . 0.0 111.877 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -58.39 -47.95 82.21 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.359 1.464 . . . . 0.0 111.587 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.29 -28.38 69.68 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.113 1.765 . . . . 0.0 113.67 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -71.06 -39.05 72.47 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.096 -1.003 . . . . 0.0 110.327 172.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.28 -33.09 74.57 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.347 -0.845 . . . . 0.0 111.803 176.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.1 mt -61.09 -28.74 69.3 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.982 -1.074 . . . . 0.0 113.283 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -103.41 -20.17 14.16 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -148.09 3.15 0.69 Allowed 'General case' 0 CA--C 1.555 1.136 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 -170.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.4 m 56.66 -13.38 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -76.34 172.14 13.39 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.099 1.318 . . . . 0.0 109.887 159.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.6 m -110.72 159.72 17.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.821 0.848 . . . . 0.0 111.252 161.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 16.4 tt -66.71 128.6 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -170.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? . . . . . 0 C--O 1.255 1.37 0 C-N-CA 128.74 2.816 . . . . 0.0 110.406 175.959 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.876 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 m -97.9 162.36 13.28 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.642 0.777 . . . . 0.0 112.845 -173.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.56 -126.28 8.19 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.524 0.583 . . . . 0.0 113.365 168.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 59.1 m -78.24 61.14 2.66 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.917 1.287 . . . . 0.0 113.645 -168.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 50.0 mtt -136.66 121.18 12.64 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 127.458 2.303 . . . . 0.0 109.206 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.61 -37.24 95.45 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.754 2.303 . . . . 0.0 113.869 -177.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.5 -8.05 55.73 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -84.64 -46.02 11.92 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 163.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.3 m -56.26 -59.65 4.64 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.318 1.047 . . . . 0.0 112.513 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.06 -0.09 26.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.87 -26.02 54.54 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.774 1.178 . . . . 0.0 114.011 169.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -125.57 -22.1 4.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.6 134.48 53.14 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.718 1.145 . . . . 0.0 111.054 -174.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -115.24 143.59 45.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.411 1.484 . . . . 0.0 110.535 -164.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.03 -141.93 15.45 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 124.214 0.912 . . . . 0.0 112.876 -173.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -127.73 -45.87 1.44 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.959 1.304 . . . . 0.0 112.617 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -63.92 -39.07 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 119.374 0.988 . . . . 0.0 112.253 -177.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.9 p -63.8 -48.09 78.25 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.592 1.157 . . . . 0.0 111.983 175.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.56 -52.34 65.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.066 1.346 . . . . 0.0 111.486 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -56.96 -34.32 67.93 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.285 1.834 . . . . 0.0 113.189 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -67.36 -36.81 82.14 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 121.271 -0.893 . . . . 0.0 110.536 173.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.9 t -76.83 -31.55 56.98 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.011 -1.056 . . . . 0.0 112.561 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.63 -34.28 75.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.378 0.99 . . . . 0.0 111.816 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -87.23 -44.43 11.46 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 174.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -118.16 -5.59 10.91 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.815 1.246 . . . . 0.0 114.065 -160.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.0 m 60.84 20.9 11.09 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.884 2.073 . . . . 0.0 115.881 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -137.33 170.49 15.99 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 129.267 3.027 . . . . 0.0 108.018 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -107.38 142.42 37.23 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.87 1.668 . . . . 0.0 112.11 173.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.1 tt -52.59 134.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.374 1.47 . . . . 0.0 113.212 -169.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? . . . . . 0 C--O 1.25 1.09 0 CA-C-O 116.658 -1.639 . . . . 0.0 111.61 170.399 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.421 ' HA3' ' SD ' ' A' ' 5' ' ' MET . . . . . . . . 0 N--CA 1.471 0.976 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -69.44 148.58 49.38 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.448 1.099 . . . . 0.0 113.304 -173.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.28 -167.08 40.92 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.647 1.118 . . . . 0.0 113.828 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 59.6 m -77.79 56.22 1.49 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.192 1.797 . . . . 0.0 111.933 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.421 ' SD ' ' HA3' ' A' ' 1' ' ' GLY . 39.2 mtt -71.36 160.87 81.26 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.906 1.283 . . . . 0.0 111.206 170.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.06 -34.25 98.86 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.805 1.67 . . . . 0.0 115.442 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -63.58 -41.17 98.4 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.009 1.277 . . . . 0.0 112.91 176.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -63.49 -46.92 83.92 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.973 0.909 . . . . 0.0 110.47 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 85.0 m -67.14 -38.13 85.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.996 0.918 . . . . 0.0 113.243 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.0 -7.13 57.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.34 -44.42 9.62 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 123.65 0.643 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -78.7 -33.97 46.43 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.2 m -113.98 158.44 21.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.914 1.285 . . . . 0.0 112.768 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 -119.83 147.3 44.83 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.284 1.434 . . . . 0.0 110.524 170.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.95 -155.79 20.04 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.89 1.233 . . . . 0.0 111.629 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -129.13 -42.86 1.34 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.431 1.115 . . . . 0.0 112.656 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -64.82 -36.6 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.297 0.953 . . . . 0.0 110.906 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.7 p -59.29 -43.31 92.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.08 0.952 . . . . 0.0 112.49 172.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -65.97 -45.62 81.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.044 1.338 . . . . 0.0 111.006 175.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.04 -33.37 75.58 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.799 1.24 . . . . 0.0 113.66 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -67.93 -38.93 83.49 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.639 -1.288 . . . . 0.0 110.513 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -65.64 -31.48 72.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.404 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.4 mt -57.69 -32.16 67.07 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.716 1.144 . . . . 0.0 112.963 177.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -104.22 -33.13 8.81 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.167 1.787 . . . . 0.0 114.367 -175.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -123.76 -3.47 8.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.639 1.176 . . . . 0.0 113.552 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 79.8 m 57.13 13.77 1.75 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -175.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -115.77 160.24 20.37 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.093 1.757 . . . . 0.0 110.89 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 m -74.9 155.56 37.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 159.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 19.2 tt -70.56 111.1 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.364 -0.835 . . . . 0.0 111.898 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 . . . . . 0 C--O 1.249 1.073 0 C-N-CA 128.641 2.776 . . . . 0.0 110.479 174.366 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.731 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 p -112.2 110.72 21.13 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.702 2.001 . . . . 0.0 111.22 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 154.84 -170.88 33.15 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 126.26 1.886 . . . . 0.0 112.771 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 33.9 m -80.96 54.34 2.18 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.0 1.32 . . . . 0.0 110.537 174.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 44.0 mtt -84.71 151.61 58.56 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.705 2.002 . . . . 0.0 111.256 -171.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.11 -34.64 79.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.389 1.393 . . . . 0.0 114.5 -170.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -78.26 -14.03 59.61 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -83.9 -42.24 16.56 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.127 0.971 . . . . 0.0 110.513 165.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.5 m -62.57 -41.57 99.01 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.38 -0.825 . . . . 0.0 112.488 177.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.29 -5.45 49.48 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 170.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.18 -31.6 27.98 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.529 1.061 . . . . 0.0 113.178 167.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -106.9 -19.66 13.57 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.3 137.29 54.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.82 1.248 . . . . 0.0 111.049 -175.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -106.18 146.44 30.26 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.859 1.264 . . . . 0.0 110.661 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.0 -143.95 16.98 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 123.954 0.787 . . . . 0.0 112.249 -168.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -139.42 -43.84 0.45 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.612 1.165 . . . . 0.0 113.223 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.2 t -64.11 -37.43 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.657 0.783 . . . . 0.0 110.145 174.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 91.6 p -61.78 -45.43 93.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.976 1.31 . . . . 0.0 112.989 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.95 -48.22 81.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.396 1.479 . . . . 0.0 110.816 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.99 -30.16 70.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.997 1.319 . . . . 0.0 113.549 175.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -69.96 -41.39 74.58 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.088 -1.007 . . . . 0.0 110.199 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.1 t -62.97 -35.35 79.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.295 -0.86 . . . . 0.0 112.606 176.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.79 -38.81 67.76 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.587 0.708 . . . . 0.0 111.968 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -91.51 -53.55 4.27 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.923 1.289 . . . . 0.0 111.624 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -103.86 -1.96 26.99 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.741 1.616 . . . . 0.0 114.574 -162.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.5 m 56.28 30.21 16.3 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.119 1.368 . . . . 0.0 114.486 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -139.2 160.1 40.6 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.061 2.144 . . . . 0.0 111.002 176.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -82.87 137.17 34.36 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 162.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 tt -61.14 147.16 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 122.005 -0.435 . . . . 0.0 111.663 -176.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.248 0 C-N-CA 125.158 1.383 . . . . 0.0 113.618 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.3 p -138.18 167.54 21.62 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.344 1.058 . . . . 0.0 113.141 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 169.79 -171.58 43.38 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.34 0.971 . . . . 0.0 111.966 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.03 62.44 2.16 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.896 1.278 . . . . 0.0 111.892 178.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 28.7 mtt -74.13 136.24 76.15 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 125.87 1.668 . . . . 0.0 111.526 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -56.34 -39.13 93.32 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.609 2.206 . . . . 0.0 113.999 173.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -35.48 79.39 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.118 -0.989 . . . . 0.0 112.648 174.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -76.7 -31.84 57.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.995 0.918 . . . . 0.0 112.08 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.2 m -60.13 -43.87 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.979 -1.076 . . . . 0.0 112.145 168.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.58 -19.47 45.52 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.62 -48.03 77.24 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 121.167 -0.958 . . . . 0.0 111.546 165.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -75.08 -55.55 5.62 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.504 1.122 . . . . 0.0 113.609 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.85 146.41 25.98 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.013 0.925 . . . . 0.0 112.434 -164.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmt-85 -106.41 124.81 50.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.697 1.199 . . . . 0.0 111.795 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.15 -157.61 15.46 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.765 1.174 . . . . 0.0 114.548 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -105.48 -53.41 2.66 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.568 1.547 . . . . 0.0 110.779 -178.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.0 t -63.31 -37.28 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.538 0.735 . . . . 0.0 111.498 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.3 p -69.74 -45.32 68.4 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.363 1.065 . . . . 0.0 112.822 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.47 -49.64 76.77 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.536 1.135 . . . . 0.0 110.857 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -61.16 -28.09 68.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.061 1.344 . . . . 0.0 113.758 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.78 -40.67 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.92 -1.113 . . . . 0.0 110.918 172.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.0 t -67.22 -28.38 68.02 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.426 -0.796 . . . . 0.0 112.211 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.58 -16.67 63.93 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.35 -49.42 2.96 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.873 1.269 . . . . 0.0 113.874 173.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -101.03 -6.45 24.4 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.542 1.537 . . . . 0.0 113.816 -169.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.7 m 58.87 23.39 11.3 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.9 mtm105 -128.84 163.81 24.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.146 2.178 . . . . 0.0 110.431 170.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.3 m -71.91 153.32 41.93 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.762 -0.586 . . . . 0.0 109.927 157.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.3 tt -66.77 93.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.492 1.117 . . . . 0.0 113.096 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 125.835 1.654 . . . . 0.0 110.325 173.469 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 CA--C 1.548 0.869 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.05 -37.78 79.5 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.558 2.839 . . . . 0.0 115.463 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.58 -31.22 72.14 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.678 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -70.63 -43.53 69.03 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.702 -0.624 . . . . 0.0 110.834 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.6 m -63.06 -59.03 5.36 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.512 0.596 . . . . 0.0 112.243 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.51 -25.06 59.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -172.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.77 64.04 Favored Glycine 0 CA--C 1.537 1.422 0 CA-C-O 118.673 -1.07 . . . . 0.0 115.101 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -132.66 -30.54 1.43 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.2 m -90.36 131.49 36.12 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.725 1.148 . . . . 0.0 111.013 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.91 155.01 39.14 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -165.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.1 -128.2 8.88 Favored Glycine 0 N--CA 1.467 0.705 0 C-N-CA 123.723 0.678 . . . . 0.0 112.429 159.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -137.71 -32.32 0.76 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.463 1.105 . . . . 0.0 113.345 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 68.1 t -70.0 -47.13 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.039 1.336 . . . . 0.0 112.156 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.5 t -63.44 -41.57 98.66 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 121.197 -0.939 . . . . 0.0 111.039 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -56.05 -48.88 75.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.398 0.679 . . . . 0.0 111.436 170.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -65.51 -27.16 68.28 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.103 1.361 . . . . 0.0 113.772 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -69.35 -35.87 76.31 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 120.581 -1.324 . . . . 0.0 110.431 170.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.89 -42.16 58.36 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.566 -0.709 . . . . 0.0 110.626 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.72 -42.25 96.88 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.939 -1.101 . . . . 0.0 112.443 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 mtmm -78.54 -38.45 40.48 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.73 1.88 1.19 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -156.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.25 86.0 m 56.12 41.39 29.57 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.276 2.231 . . . . 0.0 116.355 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -129.83 158.75 38.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.696 1.599 . . . . 0.0 110.457 169.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.7 m -116.18 139.0 50.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 122.341 1.067 . . . . 0.0 111.881 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 tt . . . . . 0 N--CA 1.471 0.613 0 C-N-CA 125.954 1.701 . . . . 0.0 112.844 -165.757 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 64.4 mtm . . . . . 0 CA--C 1.541 0.631 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.292 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.87 -31.93 96.31 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.195 1.93 . . . . 0.0 114.939 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.9 -20.73 62.47 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 114.708 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -85.37 -46.3 11.08 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.968 1.707 . . . . 0.0 110.224 168.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.2 m -59.95 -48.98 79.5 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.652 0.781 . . . . 0.0 112.989 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.15 -10.16 59.5 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 173.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.46 -33.31 39.45 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.84 1.209 . . . . 0.0 113.175 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -98.02 -19.64 17.88 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.1 m -130.73 145.03 51.84 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.435 1.094 . . . . 0.0 112.687 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 mmp_? -99.45 162.22 13.16 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.38 2.272 . . . . 0.0 110.561 169.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 94.99 -145.27 17.64 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-O 118.974 -0.903 . . . . 0.0 112.101 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -140.7 -53.4 0.49 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.106 1.453 . . . . 0.0 114.724 -169.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -70.63 -32.53 49.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.818 0.847 . . . . 0.0 110.436 175.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.0 p -54.12 -54.74 35.46 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 125.97 1.708 . . . . 0.0 111.854 168.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -62.86 -42.14 99.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.628 1.171 . . . . 0.0 111.92 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.69 -28.47 60.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -175.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -65.77 -30.57 71.24 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.159 -1.588 . . . . 0.0 110.197 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.0 t -70.22 -25.58 63.46 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.657 -0.652 . . . . 0.0 111.689 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 mt -75.38 -29.45 59.86 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.7 -32.9 11.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.045 0.938 . . . . 0.0 113.359 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -137.91 10.37 2.85 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.946 1.299 . . . . 0.0 113.755 -162.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.0 m 63.43 7.45 2.98 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.893 2.553 . . . . 0.0 117.893 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.6 mtm105 -131.87 159.97 37.06 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.26 1.424 . . . . 0.0 111.645 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 m -78.54 159.01 28.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 118.257 0.481 . . . . 0.0 110.236 158.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 15.2 tt . . . . . 0 N--CA 1.471 0.624 0 CA-C-O 123.522 1.629 . . . . 0.0 114.653 -156.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 57.7 mtt . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.33 -40.67 65.96 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.36 2.04 . . . . 0.0 113.611 -178.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -69.42 -7.04 34.19 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 174.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -96.68 -43.58 7.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 111.074 166.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 89.6 m -61.37 -30.9 70.82 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.853 -1.155 . . . . 0.0 113.661 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.76 -5.06 54.56 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.54 -27.34 15.16 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.738 1.161 . . . . 0.0 113.477 163.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -88.05 -28.84 21.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 60.5 m -131.43 149.9 52.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.631 1.173 . . . . 0.0 112.873 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -110.81 135.16 51.8 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.311 1.444 . . . . 0.0 110.715 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.34 -145.07 18.63 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.258 1.409 . . . . 0.0 112.713 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -137.99 -44.77 0.52 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.073 1.349 . . . . 0.0 112.911 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.85 -41.0 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.359 1.064 . . . . 0.0 109.978 170.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -59.79 -43.26 94.51 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.88 0.872 . . . . 0.0 112.419 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.16 -27.51 68.07 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.672 1.189 . . . . 0.0 113.756 175.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -78.75 -36.16 43.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.584 1.083 . . . . 0.0 113.28 167.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.05 -43.92 95.04 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.416 -1.428 . . . . 0.0 111.03 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.8 t -58.37 -27.2 63.99 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.558 1.143 . . . . 0.0 113.642 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -62.4 -29.04 70.2 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.908 1.231 . . . . 0.0 113.563 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -111.0 -38.74 4.99 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.131 0.972 . . . . 0.0 113.054 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -92.58 -22.66 19.38 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -171.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.7 m 55.8 21.43 4.74 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.703 1.601 . . . . 0.0 115.091 -173.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -117.09 170.7 8.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.733 2.013 . . . . 0.0 109.485 161.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 m -77.31 174.1 11.16 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 155.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.263 14.4 tt . . . . . 0 CA--C 1.548 0.886 0 O-C-N 120.774 -1.204 . . . . 0.0 113.904 -167.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 60.0 mtm . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.83 -44.24 50.93 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.514 2.809 . . . . 0.0 115.078 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pm0 -74.63 -8.54 56.69 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -91.88 -42.1 10.24 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.734 1.614 . . . . 0.0 110.482 167.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 93.8 m -59.64 -46.32 89.36 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.183 0.993 . . . . 0.0 112.138 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -16.16 61.89 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.07 -27.55 70.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.727 -1.041 . . . . 0.0 113.135 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -104.46 -35.7 7.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.775 1.768 . . . . 0.0 115.775 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.1 m -106.1 146.61 29.96 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.015 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -117.82 137.53 52.7 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.957 1.303 . . . . 0.0 111.504 -171.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.15 -156.53 25.26 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 123.725 0.678 . . . . 0.0 111.946 -161.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -116.49 -46.94 2.75 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 0.0 112.216 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.99 -35.79 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.735 0.814 . . . . 0.0 110.964 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.6 p -66.09 -45.17 82.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.786 1.234 . . . . 0.0 112.752 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -63.63 -43.5 96.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.217 1.007 . . . . 0.0 110.461 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.07 -29.16 70.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.363 1.065 . . . . 0.0 113.437 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -70.87 -37.13 73.05 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.147 -0.971 . . . . 0.0 110.356 175.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 37.2 t -64.42 -34.59 78.53 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.96 -1.088 . . . . 0.0 111.374 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.72 -34.81 73.39 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -119.72 2.1 11.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.196 1.398 . . . . 0.0 114.012 -168.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -145.17 -15.27 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.909 1.283 . . . . 0.0 114.121 -177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.0 m 58.76 37.78 24.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.902 1.281 . . . . 0.0 114.032 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 54.1 mtp85 -141.76 161.52 37.75 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.64 2.376 . . . . 0.0 110.327 171.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -86.11 135.53 33.57 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.807 0.73 . . . . 0.0 110.122 164.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 2.7 tt . . . . . 0 N--CA 1.478 0.938 0 O-C-N 121.261 -0.899 . . . . 0.0 110.165 173.722 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 52.9 mtt . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.71 -35.88 94.0 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.548 2.832 . . . . 0.0 115.755 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -71.95 -36.47 69.89 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.459 0.704 . . . . 0.0 111.944 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.22 -37.2 77.9 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.595 -0.69 . . . . 0.0 111.152 175.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.8 m -61.7 -54.68 39.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.484 0.714 . . . . 0.0 111.603 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.66 60.29 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.67 2.48 39.72 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.803 1.192 . . . . 0.0 115.731 172.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -143.34 -39.15 0.32 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.291 1.545 . . . . 0.0 114.259 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 83.0 m -94.67 141.56 28.47 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.167 0.987 . . . . 0.0 111.222 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -104.11 159.24 15.84 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 112.731 -164.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.05 -135.03 12.83 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.503 1.525 . . . . 0.0 113.711 175.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.1 tttp -132.76 -45.47 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.349 1.46 . . . . 0.0 112.912 174.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -61.82 -39.93 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.038 0.835 . . . . 0.0 112.087 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.1 t -76.61 -38.85 54.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.632 0.773 . . . . 0.0 112.316 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -56.71 -50.66 71.5 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.429 -0.794 . . . . 0.0 111.189 168.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -58.86 -29.25 66.82 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.945 1.698 . . . . 0.0 113.212 173.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -68.33 -43.34 77.76 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.082 -1.011 . . . . 0.0 110.862 174.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.39 -26.58 66.52 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -62.75 -26.68 68.82 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 120.973 -1.079 . . . . 0.0 113.612 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -102.56 -38.34 7.57 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.921 1.289 . . . . 0.0 113.605 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -118.51 -14.0 9.69 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -161.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.8 t 56.66 -11.75 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.588 2.355 . . . . 0.0 116.979 -172.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -75.16 167.27 22.24 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.758 -1.214 . . . . 0.0 109.489 151.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.0 m -98.86 164.02 12.37 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.262 1.025 . . . . 0.0 109.937 159.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 tt . . . . . 0 CA--C 1.551 0.988 0 O-C-N 121.245 -0.909 . . . . 0.0 113.442 -163.189 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 119.124 -0.465 . . . . 0.0 112.161 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -58.54 -35.91 98.05 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.038 1.825 . . . . 0.0 114.496 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -34.49 74.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.287 1.035 . . . . 0.0 113.442 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.14 -48.87 18.98 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.085 1.354 . . . . 0.0 110.756 170.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.1 m -63.87 -39.44 94.21 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.5 53.15 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 174.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.68 -23.96 24.61 Favored Glycine 0 CA--C 1.538 1.528 0 C-N-CA 125.093 1.33 . . . . 0.0 113.456 165.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -81.44 -42.85 19.75 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.504 1.122 . . . . 0.0 112.745 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 91.1 m -135.88 147.81 48.35 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.518 1.127 . . . . 0.0 113.41 -162.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -114.89 147.88 39.35 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.916 1.687 . . . . 0.0 110.415 -169.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.51 -142.44 16.16 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 -164.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.05 -43.01 0.26 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.581 1.191 . . . . 0.0 113.646 -178.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.55 -37.6 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.421 0.688 . . . . 0.0 110.964 172.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.2 p -61.55 -44.65 96.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.943 1.297 . . . . 0.0 112.388 172.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.07 -48.46 78.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.821 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.39 -33.35 71.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.352 1.461 . . . . 0.0 112.904 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.99 -40.52 91.27 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.933 -1.104 . . . . 0.0 110.608 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.2 t -65.38 -35.57 81.36 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.562 0.745 . . . . 0.0 112.835 173.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.12 -36.17 67.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.577 1.08 . . . . 0.0 112.338 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -99.54 -35.87 9.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.988 1.315 . . . . 0.0 113.952 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -126.81 -1.3 6.65 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.415 1.086 . . . . 0.0 113.508 -166.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 58.58 -22.62 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 129.001 2.92 . . . . 0.0 117.84 -175.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -69.88 174.2 5.52 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.012 1.725 . . . . 0.0 109.837 163.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.74 158.55 19.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 111.03 161.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.6 tt . . . . . 0 N--CA 1.473 0.697 0 C-N-CA 125.05 1.34 . . . . 0.0 113.622 -173.243 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -53.03 -42.55 63.78 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.632 2.888 . . . . 0.0 114.886 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.68 -27.91 69.57 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.74 1.216 . . . . 0.0 113.986 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -80.92 -38.03 28.57 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 111.687 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.7 m -54.1 -48.05 71.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.317 0.647 . . . . 0.0 111.145 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.09 -27.91 61.12 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.6 -38.41 78.37 Favored Glycine 0 CA--C 1.536 1.346 0 O-C-N 121.346 -0.847 . . . . 0.0 113.573 173.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -85.06 -28.32 25.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.635 1.174 . . . . 0.0 113.716 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.1 m -126.61 138.96 53.51 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.396 0.998 . . . . 0.0 113.095 -166.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -98.56 137.28 37.45 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.021 1.728 . . . . 0.0 111.998 -170.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.14 -139.51 14.58 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.221 0.915 . . . . 0.0 112.416 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -136.88 -51.72 0.68 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.795 1.638 . . . . 0.0 112.819 -174.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.35 -38.51 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 0.0 110.827 174.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 86.5 p -58.51 -45.6 88.46 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.937 0.895 . . . . 0.0 112.512 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -62.91 -51.09 68.32 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.567 1.547 . . . . 0.0 110.553 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.62 -26.41 68.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.405 1.482 . . . . 0.0 113.801 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -62.99 -42.93 99.98 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.566 -1.334 . . . . 0.0 110.333 170.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -70.58 -33.12 70.73 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 111.629 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.23 -29.7 68.93 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mtmm -112.3 -22.33 10.96 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -130.94 -9.05 3.91 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.959 1.304 . . . . 0.0 113.557 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.284 7.8 t 47.57 40.06 10.87 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.512 1.925 . . . . 0.0 114.405 -172.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -136.03 159.9 40.28 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.615 2.366 . . . . 0.0 109.371 164.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.44 147.9 24.26 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.488 0.585 . . . . 0.0 111.13 163.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.4 tt . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 124.937 1.295 . . . . 0.0 111.52 -167.787 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mtp . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 118.868 -0.587 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.04 -39.35 91.73 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.587 2.192 . . . . 0.0 114.564 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.47 -25.97 64.34 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -71.39 -45.07 63.71 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.121 -0.987 . . . . 0.0 110.705 170.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 81.0 m -58.06 -49.74 75.87 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.403 0.681 . . . . 0.0 112.528 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.71 -22.22 43.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.23 -28.69 72.46 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 118.748 -1.029 . . . . 0.0 113.518 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -103.44 -37.41 7.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.184 1.492 . . . . 0.0 114.371 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.47 144.29 37.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.181 1.355 . . . . 0.0 113.288 -169.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -113.56 137.47 51.52 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.056 1.342 . . . . 0.0 111.089 -165.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.08 -160.97 17.53 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.056 0.836 . . . . 0.0 112.695 -168.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -114.69 -44.13 3.09 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.665 1.586 . . . . 0.0 111.146 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.93 -38.78 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.485 0.714 . . . . 0.0 111.556 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -63.62 -48.01 79.02 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.224 1.409 . . . . 0.0 112.194 176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.32 -46.91 86.61 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.872 1.269 . . . . 0.0 111.333 175.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.44 -23.2 64.58 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.841 0.856 . . . . 0.0 113.023 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.32 -36.26 83.51 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.471 -1.393 . . . . 0.0 109.953 168.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.47 -35.3 46.84 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.461 -0.774 . . . . 0.0 112.088 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -59.16 -40.13 84.62 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.03 0.832 . . . . 0.0 112.02 173.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -93.6 -30.87 14.74 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -139.8 3.94 2.08 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -164.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.281 4.3 t 50.83 19.18 0.59 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 128.025 2.53 . . . . 0.0 117.215 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.1 mmt-85 -111.48 168.46 9.53 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.475 1.51 . . . . 0.0 109.181 163.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -99.07 160.98 13.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.496 0.665 . . . . 0.0 111.122 163.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 14.7 tt . . . . . 0 CA--C 1.54 0.569 0 O-C-N 121.643 -0.66 . . . . 0.0 111.061 -178.724 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 mmt . . . . . 0 CA--C 1.544 0.718 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -55.61 -40.47 85.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.404 2.736 . . . . 0.0 116.32 -171.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -72.11 -29.12 63.77 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.465 1.106 . . . . 0.0 112.527 175.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -81.63 -29.74 33.11 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.056 1.343 . . . . 0.0 112.109 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 92.2 m -57.09 -42.87 81.53 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.079 -1.013 . . . . 0.0 110.546 164.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.03 -2.81 38.96 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -50.73 3.91 Favored Glycine 0 CA--C 1.534 1.235 0 O-C-N 121.314 -0.866 . . . . 0.0 111.61 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.45 -33.29 74.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.721 0.808 . . . . 0.0 113.054 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.4 m -136.87 144.1 43.39 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 0.0 112.641 -165.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -132.11 142.31 49.46 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.306 -0.871 . . . . 0.0 112.42 -168.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.18 -152.71 18.0 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.539 1.542 . . . . 0.0 111.323 -165.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -118.9 -45.41 2.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.932 1.693 . . . . 0.0 112.019 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.14 -36.42 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.185 1.394 . . . . 0.0 111.143 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 64.4 p -57.97 -45.83 86.1 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.118 0.967 . . . . 0.0 111.856 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -66.21 -47.73 72.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.316 1.046 . . . . 0.0 111.821 174.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -57.93 -32.16 67.52 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.185 1.394 . . . . 0.0 114.07 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.03 -34.07 74.63 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.928 174.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 48.1 t -77.56 -29.22 52.05 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.081 -1.012 . . . . 0.0 111.931 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.69 -38.69 91.4 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -98.96 -28.19 13.53 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -173.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -139.94 -1.43 1.59 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -166.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t 44.21 57.93 4.01 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.573 1.549 . . . . 0.0 113.334 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -139.78 167.66 21.6 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.918 2.887 . . . . 0.0 108.696 170.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.4 m -128.33 144.99 51.2 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.395 0.678 . . . . 0.0 111.312 170.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.472 0.631 0 C-N-CA 123.425 0.69 . . . . 0.0 112.826 -165.15 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 59.7 mtt . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 118.637 -0.697 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.6 -38.78 92.45 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.418 2.078 . . . . 0.0 115.079 -169.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -68.68 -30.61 69.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 114.286 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -82.52 -33.42 28.25 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.081 0.855 . . . . 0.0 110.792 173.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.2 m -65.49 -31.47 72.56 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.054 0.942 . . . . 0.0 113.27 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.43 17.0 19.94 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.232 1.413 . . . . 0.0 114.07 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.86 -40.09 85.05 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.767 1.175 . . . . 0.0 113.597 173.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -128.08 7.04 6.0 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.04 1.736 . . . . 0.0 113.637 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.2 m -137.12 139.24 41.07 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.711 1.604 . . . . 0.0 112.012 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -111.79 174.39 5.9 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.577 1.951 . . . . 0.0 111.641 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 -158.49 39.48 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.425 1.012 . . . . 0.0 113.357 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -113.42 -46.37 3.07 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.767 1.627 . . . . 0.0 111.518 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.3 t -60.92 -45.18 98.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 118.795 0.725 . . . . 0.0 111.771 -171.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -80.09 -38.28 32.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.171 0.588 . . . . 0.0 112.121 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -59.12 -48.39 81.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.41 -0.806 . . . . 0.0 112.065 170.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -22.97 61.51 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.48 1.037 . . . . 0.0 113.345 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.45 ' CD2' ' HA ' ' A' ' 29' ' ' ILE . 23.9 t80 -60.97 -43.67 98.46 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.51 -0.744 . . . . 0.0 109.3 168.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -69.06 -31.11 69.64 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.304 -0.873 . . . . 0.0 112.943 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.06 -24.68 67.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 120.029 1.286 . . . . 0.0 113.348 174.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -99.97 -43.7 6.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.837 1.255 . . . . 0.0 113.144 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -114.7 -7.39 12.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.423 1.889 . . . . 0.0 114.203 -161.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m 62.18 9.56 3.25 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.089 2.156 . . . . 0.0 116.473 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.0 mtm105 -119.9 162.33 19.35 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 0.0 110.61 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.8 m -81.72 147.26 29.56 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.345 0.658 . . . . 0.0 109.779 160.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.45 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 14.4 tt . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 117.256 2.317 . . . . 0.0 117.256 -151.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -61.34 -35.31 84.63 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 121.68 1.587 . . . . 0.0 115.001 -166.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -77.01 -21.73 54.18 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.421 1.488 . . . . 0.0 113.922 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -81.17 -42.26 21.12 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.229 1.412 . . . . 0.0 109.97 170.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 84.5 m -58.77 -43.35 90.37 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.302 -0.874 . . . . 0.0 112.724 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.96 -12.61 59.97 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.24 -39.28 32.02 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 118.525 0.602 . . . . 0.0 113.136 168.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -94.37 -24.45 17.37 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.9 m -112.59 135.41 53.34 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.026 0.93 . . . . 0.0 112.328 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -104.33 148.53 26.28 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.689 . . . . 0.0 110.508 171.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.67 -160.96 28.09 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.6 1.095 . . . . 0.0 111.929 -162.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -125.8 -45.57 1.75 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.865 1.666 . . . . 0.0 112.206 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.21 -38.45 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 118.985 0.812 . . . . 0.0 110.85 173.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -66.34 -46.43 76.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.68 1.592 . . . . 0.0 112.813 176.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -61.52 -43.6 98.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.375 1.07 . . . . 0.0 110.357 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.04 -28.22 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.703 1.201 . . . . 0.0 113.385 174.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.62 -33.23 72.36 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.071 173.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.76 -33.52 66.39 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.689 -1.257 . . . . 0.0 111.633 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.0 mt -59.23 -38.81 80.89 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.882 0.765 . . . . 0.0 112.533 173.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.7 mtmm -102.02 -23.17 14.13 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -136.93 -5.34 1.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -170.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t 53.06 41.89 32.19 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -134.06 161.45 34.82 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.109 1.764 . . . . 0.0 109.631 163.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.1 m -84.41 141.66 30.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 153.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.278 -173.726 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 118.858 -0.591 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.64 -34.42 92.22 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.367 2.044 . . . . 0.0 115.119 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -72.04 -21.67 61.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.235 1.414 . . . . 0.0 114.399 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 -45.75 17.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.385 0.674 . . . . 0.0 109.886 169.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 70.5 m -56.95 -52.03 66.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.922 0.889 . . . . 0.0 111.92 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.8 -21.06 44.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.39 -22.93 78.57 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.916 171.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -116.32 -10.71 11.34 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.811 1.306 . . . . 0.0 114.498 -176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 m -138.35 134.81 34.68 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.695 1.198 . . . . 0.0 111.171 -173.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -99.91 156.34 17.19 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.255 1.422 . . . . 0.0 112.518 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.86 -153.09 29.33 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.292 1.425 . . . . 0.0 112.236 -173.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -125.87 -32.76 2.78 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.574 1.187 . . . . 0.0 113.633 -178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -66.12 -44.22 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.136 0.88 . . . . 0.0 110.106 175.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 t -61.36 -45.78 92.96 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.239 1.415 . . . . 0.0 111.189 177.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.94 -52.38 56.66 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.478 1.111 . . . . 0.0 113.129 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.98 -24.53 67.75 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -175.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' A' ' 29' ' ' ILE . 12.4 t80 -65.89 -36.67 84.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.459 -0.776 . . . . 0.0 111.606 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -71.34 -28.36 64.02 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.524 1.13 . . . . 0.0 112.007 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.6 mt -66.8 -16.25 64.14 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.89 -12.39 7.54 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -143.13 4.6 1.44 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -171.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t 58.28 -22.24 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 129.435 3.094 . . . . 0.0 118.08 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -77.19 160.56 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.777 -1.202 . . . . 0.0 109.994 165.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.4 m -101.95 103.87 14.53 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.642 0.777 . . . . 0.0 110.645 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.424 ' H ' ' HB3' ' A' ' 21' ' ' TYR 0.401 9.6 tp . . . . . 0 N--CA 1.485 1.32 1 C-N-CA 133.075 4.55 . . . . 0.0 119.463 174.264 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 119.096 -0.478 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -54.92 -35.3 88.99 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.677 2.251 . . . . 0.0 113.961 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.64 -27.29 65.87 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.69 1.132 . . . . 0.0 113.594 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -74.24 -45.64 46.73 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 110.713 168.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.96 -47.68 83.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.244 -0.91 . . . . 0.0 112.963 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.03 -4.25 56.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.699 1.2 . . . . 0.0 113.433 173.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.81 -46.32 7.26 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.875 1.226 . . . . 0.0 111.435 165.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -72.95 -37.39 67.14 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.824 1.25 . . . . 0.0 113.94 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.3 m -139.3 144.78 38.47 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -160.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.93 163.56 13.97 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.161 2.184 . . . . 0.0 112.694 -176.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.49 -144.88 20.83 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.652 1.12 . . . . 0.0 112.085 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -136.18 -37.66 0.71 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.681 1.192 . . . . 0.0 112.371 -172.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.99 -47.57 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.215 1.006 . . . . 0.0 111.455 175.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -72.09 -39.63 68.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.638 0.775 . . . . 0.0 112.191 -174.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -55.6 -47.39 76.57 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.958 0.503 . . . . 0.0 111.045 169.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.31 -29.53 70.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.917 1.287 . . . . 0.0 113.802 174.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -64.2 -40.38 95.96 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.845 -1.159 . . . . 0.0 110.319 175.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.4 t -68.8 -29.95 68.41 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.299 0.639 . . . . 0.0 112.514 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.95 -28.02 69.25 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.087 -1.008 . . . . 0.0 113.458 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -118.62 -29.3 5.45 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -102.76 -15.19 16.35 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.5 1.52 . . . . 0.0 112.626 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.282 8.5 t 51.22 32.12 7.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.121 1.768 . . . . 0.0 114.624 -169.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -131.36 161.32 32.65 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.703 1.601 . . . . 0.0 109.388 168.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 67.6 m -78.47 158.29 28.68 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 161.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.6 tt . . . . . 0 N--CA 1.474 0.767 0 O-C-N 121.039 -1.038 . . . . 0.0 112.418 -174.058 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.6 mmt . . . . . 0 N--CA 1.473 0.688 0 CA-C-O 118.877 -0.582 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.44 -42.73 45.78 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 122.245 1.963 . . . . 0.0 115.139 -166.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -68.83 -26.48 65.19 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.633 -0.667 . . . . 0.0 112.7 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -88.69 -33.11 17.67 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.416 1.486 . . . . 0.0 112.061 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 94.3 m -57.16 -40.69 77.78 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.116 -0.99 . . . . 0.0 111.325 165.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.22 -1.88 42.5 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 177.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.33 -50.98 2.47 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.292 0.949 . . . . 0.0 112.151 164.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -76.42 -26.58 55.65 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.4 m -118.04 140.79 49.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.552 1.541 . . . . 0.0 111.412 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -114.47 142.68 46.06 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.208 1.403 . . . . 0.0 111.291 -174.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 100.46 -133.7 11.41 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 125.065 1.317 . . . . 0.0 113.462 -171.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.46 -53.1 0.83 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.006 1.322 . . . . 0.0 111.918 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.69 -34.68 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.863 0.865 . . . . 0.0 111.919 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.9 p -63.31 -44.16 95.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.433 1.093 . . . . 0.0 112.469 170.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.94 -43.15 83.95 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.279 1.031 . . . . 0.0 111.062 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.253 0.5 OUTLIER -70.53 -21.58 62.71 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.981 1.264 . . . . 0.0 113.399 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -68.76 -32.71 72.66 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.047 -1.033 . . . . 0.0 111.296 166.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -76.17 -33.05 59.35 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.973 -1.079 . . . . 0.0 111.73 173.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.51 -40.22 96.48 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.258 -0.901 . . . . 0.0 112.681 172.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -91.76 -39.73 11.63 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -128.03 3.72 5.89 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.934 1.294 . . . . 0.0 113.427 -164.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.3 t 63.72 10.96 5.46 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.0 mtm-85 -118.61 169.89 9.42 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.798 1.639 . . . . 0.0 111.4 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 39.6 m -79.52 162.33 25.46 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 157.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.302 16.3 tt . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 123.968 1.842 . . . . 0.0 113.024 -173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.1 mmt . . . . . 0 CA--C 1.543 0.703 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.47 -37.52 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.396 2.73 . . . . 0.0 115.506 -178.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -68.8 -27.29 65.73 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.649 1.58 . . . . 0.0 114.426 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -82.74 -35.63 26.48 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.334 1.054 . . . . 0.0 110.145 173.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.4 m -59.12 -49.62 77.16 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.388 1.075 . . . . 0.0 112.566 174.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.31 5.35 15.01 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 173.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.58 -62.06 1.82 Allowed Glycine 0 CA--C 1.533 1.206 0 O-C-N 121.504 -0.748 . . . . 0.0 111.274 156.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -72.17 -26.78 62.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.055 1.742 . . . . 0.0 115.261 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.0 m -121.82 148.94 44.05 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.868 1.267 . . . . 0.0 112.297 -170.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -121.29 140.32 52.23 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.202 1.801 . . . . 0.0 110.316 -176.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.59 162.74 33.82 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 123.511 0.577 . . . . 0.0 113.159 -170.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -82.47 -39.95 21.8 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.99 1.316 . . . . 0.0 110.689 -164.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.03 -39.12 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 124.861 1.264 . . . . 0.0 111.308 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.5 t -72.15 -43.36 64.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.891 0.769 . . . . 0.0 111.971 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -58.29 -42.69 87.13 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.31 -0.869 . . . . 0.0 111.651 168.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -66.94 -23.86 66.01 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 173.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -69.63 -36.1 75.83 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.18 -1.575 . . . . 0.0 110.654 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.8 t -71.34 -33.1 69.31 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.806 -0.559 . . . . 0.0 111.713 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.25 -39.09 78.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.04 0.837 . . . . 0.0 112.521 174.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -105.45 -26.28 12.0 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -168.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -135.17 5.47 3.28 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.225 1.41 . . . . 0.0 113.092 -171.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.8 m 54.64 28.08 9.49 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 175.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -132.27 166.49 21.77 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.309 1.844 . . . . 0.0 110.88 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 m -70.18 163.62 25.97 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 151.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 11.8 tt . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -169.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 76.4 mtm . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.88 -36.53 98.17 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.033 2.489 . . . . 0.0 113.61 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.18 -27.74 68.91 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.912 1.285 . . . . 0.0 114.115 177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -74.8 -48.74 23.73 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.174 0.99 . . . . 0.0 110.59 166.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 72.6 m -57.69 -43.07 84.86 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.41 -11.35 59.94 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 176.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.55 -41.7 10.99 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.577 1.084 . . . . 0.0 112.65 166.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -76.65 -26.72 55.18 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 118.576 1.188 . . . . 0.0 113.327 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.14 145.95 34.78 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -165.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -118.46 148.81 42.2 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.528 1.931 . . . . 0.0 112.414 -171.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 101.52 -138.46 13.89 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.654 1.121 . . . . 0.0 112.466 -170.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -132.36 -51.55 0.94 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.487 1.915 . . . . 0.0 112.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.9 t -70.73 -31.8 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.599 0.76 . . . . 0.0 111.239 -173.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.4 p -60.34 -53.23 60.08 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.431 1.492 . . . . 0.0 111.877 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -58.39 -47.95 82.21 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.359 1.464 . . . . 0.0 111.587 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.29 -28.38 69.68 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.113 1.765 . . . . 0.0 113.67 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -71.06 -39.05 72.47 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.096 -1.003 . . . . 0.0 110.327 172.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.28 -33.09 74.57 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.347 -0.845 . . . . 0.0 111.803 176.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.1 mt -61.09 -28.74 69.3 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.982 -1.074 . . . . 0.0 113.283 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -103.41 -20.17 14.16 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -148.09 3.15 0.69 Allowed 'General case' 0 CA--C 1.555 1.136 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 -170.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.4 m 56.66 -13.38 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -76.34 172.14 13.39 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.099 1.318 . . . . 0.0 109.887 159.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.6 m -110.72 159.72 17.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.821 0.848 . . . . 0.0 111.252 161.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 16.4 tt . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -170.125 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 50.0 mtt . . . . . 0 CA--C 1.546 0.802 0 CA-C-O 118.56 -0.733 . . . . 0.0 109.206 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.61 -37.24 95.45 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.754 2.303 . . . . 0.0 113.869 -177.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.5 -8.05 55.73 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -84.64 -46.02 11.92 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 163.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.3 m -56.26 -59.65 4.64 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.318 1.047 . . . . 0.0 112.513 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.06 -0.09 26.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.87 -26.02 54.54 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.774 1.178 . . . . 0.0 114.011 169.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -125.57 -22.1 4.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.6 134.48 53.14 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.718 1.145 . . . . 0.0 111.054 -174.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -115.24 143.59 45.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.411 1.484 . . . . 0.0 110.535 -164.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.03 -141.93 15.45 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 124.214 0.912 . . . . 0.0 112.876 -173.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -127.73 -45.87 1.44 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.959 1.304 . . . . 0.0 112.617 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -63.92 -39.07 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 119.374 0.988 . . . . 0.0 112.253 -177.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.9 p -63.8 -48.09 78.25 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.592 1.157 . . . . 0.0 111.983 175.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.56 -52.34 65.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.066 1.346 . . . . 0.0 111.486 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -56.96 -34.32 67.93 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.285 1.834 . . . . 0.0 113.189 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -67.36 -36.81 82.14 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 121.271 -0.893 . . . . 0.0 110.536 173.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.9 t -76.83 -31.55 56.98 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.011 -1.056 . . . . 0.0 112.561 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.63 -34.28 75.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.378 0.99 . . . . 0.0 111.816 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -87.23 -44.43 11.46 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 174.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -118.16 -5.59 10.91 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.815 1.246 . . . . 0.0 114.065 -160.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.0 m 60.84 20.9 11.09 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.884 2.073 . . . . 0.0 115.881 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -137.33 170.49 15.99 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 129.267 3.027 . . . . 0.0 108.018 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -107.38 142.42 37.23 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.87 1.668 . . . . 0.0 112.11 173.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 125.374 1.47 . . . . 0.0 113.212 -169.15 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 39.2 mtt . . . . . 0 CA--C 1.545 0.774 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.06 -34.25 98.86 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.805 1.67 . . . . 0.0 115.442 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -63.58 -41.17 98.4 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.009 1.277 . . . . 0.0 112.91 176.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -63.49 -46.92 83.92 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.973 0.909 . . . . 0.0 110.47 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 85.0 m -67.14 -38.13 85.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.996 0.918 . . . . 0.0 113.243 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.0 -7.13 57.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.34 -44.42 9.62 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 123.65 0.643 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -78.7 -33.97 46.43 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.2 m -113.98 158.44 21.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.914 1.285 . . . . 0.0 112.768 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 -119.83 147.3 44.83 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.284 1.434 . . . . 0.0 110.524 170.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.95 -155.79 20.04 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.89 1.233 . . . . 0.0 111.629 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -129.13 -42.86 1.34 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.431 1.115 . . . . 0.0 112.656 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -64.82 -36.6 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.297 0.953 . . . . 0.0 110.906 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.7 p -59.29 -43.31 92.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.08 0.952 . . . . 0.0 112.49 172.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -65.97 -45.62 81.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.044 1.338 . . . . 0.0 111.006 175.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.04 -33.37 75.58 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.799 1.24 . . . . 0.0 113.66 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -67.93 -38.93 83.49 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.639 -1.288 . . . . 0.0 110.513 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -65.64 -31.48 72.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.404 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.4 mt -57.69 -32.16 67.07 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.716 1.144 . . . . 0.0 112.963 177.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -104.22 -33.13 8.81 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.167 1.787 . . . . 0.0 114.367 -175.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -123.76 -3.47 8.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.639 1.176 . . . . 0.0 113.552 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 79.8 m 57.13 13.77 1.75 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -175.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -115.77 160.24 20.37 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.093 1.757 . . . . 0.0 110.89 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 m -74.9 155.56 37.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 159.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 19.2 tt . . . . . 0 CA--C 1.542 0.647 0 O-C-N 121.364 -0.835 . . . . 0.0 111.898 -176.995 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 44.0 mtt . . . . . 0 CA--C 1.541 0.624 0 CA-C-O 118.834 -0.603 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.11 -34.64 79.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.389 1.393 . . . . 0.0 114.5 -170.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -78.26 -14.03 59.61 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -83.9 -42.24 16.56 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.127 0.971 . . . . 0.0 110.513 165.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.5 m -62.57 -41.57 99.01 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.38 -0.825 . . . . 0.0 112.488 177.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.29 -5.45 49.48 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 170.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.18 -31.6 27.98 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.529 1.061 . . . . 0.0 113.178 167.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -106.9 -19.66 13.57 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.3 137.29 54.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.82 1.248 . . . . 0.0 111.049 -175.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -106.18 146.44 30.26 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.859 1.264 . . . . 0.0 110.661 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.0 -143.95 16.98 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 123.954 0.787 . . . . 0.0 112.249 -168.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -139.42 -43.84 0.45 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.612 1.165 . . . . 0.0 113.223 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.2 t -64.11 -37.43 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.657 0.783 . . . . 0.0 110.145 174.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 91.6 p -61.78 -45.43 93.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.976 1.31 . . . . 0.0 112.989 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.95 -48.22 81.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.396 1.479 . . . . 0.0 110.816 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.99 -30.16 70.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.997 1.319 . . . . 0.0 113.549 175.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -69.96 -41.39 74.58 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.088 -1.007 . . . . 0.0 110.199 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.1 t -62.97 -35.35 79.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.295 -0.86 . . . . 0.0 112.606 176.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.79 -38.81 67.76 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.587 0.708 . . . . 0.0 111.968 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -91.51 -53.55 4.27 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.923 1.289 . . . . 0.0 111.624 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -103.86 -1.96 26.99 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.741 1.616 . . . . 0.0 114.574 -162.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.5 m 56.28 30.21 16.3 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.119 1.368 . . . . 0.0 114.486 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -139.2 160.1 40.6 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.061 2.144 . . . . 0.0 111.002 176.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -82.87 137.17 34.36 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 162.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 tt . . . . . 0 N--CA 1.472 0.664 0 O-C-N 122.005 -0.435 . . . . 0.0 111.663 -176.451 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 28.7 mtt . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -56.34 -39.13 93.32 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.609 2.206 . . . . 0.0 113.999 173.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -35.48 79.39 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.118 -0.989 . . . . 0.0 112.648 174.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -76.7 -31.84 57.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.995 0.918 . . . . 0.0 112.08 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.2 m -60.13 -43.87 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.979 -1.076 . . . . 0.0 112.145 168.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.58 -19.47 45.52 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.62 -48.03 77.24 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 121.167 -0.958 . . . . 0.0 111.546 165.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -75.08 -55.55 5.62 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.504 1.122 . . . . 0.0 113.609 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.85 146.41 25.98 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.013 0.925 . . . . 0.0 112.434 -164.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmt-85 -106.41 124.81 50.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.697 1.199 . . . . 0.0 111.795 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.15 -157.61 15.46 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.765 1.174 . . . . 0.0 114.548 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -105.48 -53.41 2.66 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.568 1.547 . . . . 0.0 110.779 -178.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.0 t -63.31 -37.28 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.538 0.735 . . . . 0.0 111.498 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.3 p -69.74 -45.32 68.4 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.363 1.065 . . . . 0.0 112.822 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.47 -49.64 76.77 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.536 1.135 . . . . 0.0 110.857 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -61.16 -28.09 68.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.061 1.344 . . . . 0.0 113.758 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.78 -40.67 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.92 -1.113 . . . . 0.0 110.918 172.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.0 t -67.22 -28.38 68.02 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.426 -0.796 . . . . 0.0 112.211 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.58 -16.67 63.93 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.35 -49.42 2.96 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.873 1.269 . . . . 0.0 113.874 173.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -101.03 -6.45 24.4 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.542 1.537 . . . . 0.0 113.816 -169.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.7 m 58.87 23.39 11.3 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.9 mtm105 -128.84 163.81 24.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.146 2.178 . . . . 0.0 110.431 170.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.3 m -71.91 153.32 41.93 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.762 -0.586 . . . . 0.0 109.927 157.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.3 tt . . . . . 0 N--CA 1.473 0.72 0 C-N-CA 124.492 1.117 . . . . 0.0 113.096 -169.654 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.154 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.0 m -130.32 141.29 50.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.445 1.498 . . . . 0.0 112.25 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 104.2 4.19 44.39 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 126.101 1.81 . . . . 0.0 115.01 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.2 p -169.22 131.95 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.159 1.784 . . . . 0.0 110.11 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mmm -82.76 147.93 56.4 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 123.657 0.783 . . . . 0.0 112.063 171.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.05 -37.78 79.5 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.558 2.839 . . . . 0.0 115.463 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.58 -31.22 72.14 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.678 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -70.63 -43.53 69.03 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.702 -0.624 . . . . 0.0 110.834 171.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.6 m -63.06 -59.03 5.36 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.512 0.596 . . . . 0.0 112.243 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.51 -25.06 59.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -172.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -19.77 64.04 Favored Glycine 0 CA--C 1.537 1.422 0 CA-C-O 118.673 -1.07 . . . . 0.0 115.101 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -132.66 -30.54 1.43 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.2 m -90.36 131.49 36.12 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.725 1.148 . . . . 0.0 111.013 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.91 155.01 39.14 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -165.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.1 -128.2 8.88 Favored Glycine 0 N--CA 1.467 0.705 0 C-N-CA 123.723 0.678 . . . . 0.0 112.429 159.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -137.71 -32.32 0.76 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.463 1.105 . . . . 0.0 113.345 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 68.1 t -70.0 -47.13 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.039 1.336 . . . . 0.0 112.156 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.5 t -63.44 -41.57 98.66 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 121.197 -0.939 . . . . 0.0 111.039 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -56.05 -48.88 75.19 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.398 0.679 . . . . 0.0 111.436 170.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -65.51 -27.16 68.28 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.103 1.361 . . . . 0.0 113.772 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -69.35 -35.87 76.31 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 120.581 -1.324 . . . . 0.0 110.431 170.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 49.9 t -74.89 -42.16 58.36 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.566 -0.709 . . . . 0.0 110.626 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.72 -42.25 96.88 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.939 -1.101 . . . . 0.0 112.443 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.7 mtmm -78.54 -38.45 40.48 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.73 1.88 1.19 Allowed 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -156.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.25 86.0 m 56.12 41.39 29.57 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.276 2.231 . . . . 0.0 116.355 178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -129.83 158.75 38.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.696 1.599 . . . . 0.0 110.457 169.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.7 m -116.18 139.0 50.8 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 122.341 1.067 . . . . 0.0 111.881 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 tt -80.63 157.84 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 125.954 1.701 . . . . 0.0 112.844 -165.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.179 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 89.1 p -129.75 10.44 5.56 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.382 1.473 . . . . 0.0 114.611 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.81 162.06 10.7 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 125.105 1.336 . . . . 0.0 113.263 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 12.9 m -78.15 54.01 1.29 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.863 1.665 . . . . 0.0 112.427 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 64.4 mtm -82.65 145.25 50.4 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 125.726 1.61 . . . . 0.0 111.292 -174.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.87 -31.93 96.31 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.195 1.93 . . . . 0.0 114.939 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.9 -20.73 62.47 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.874 1.669 . . . . 0.0 114.708 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -85.37 -46.3 11.08 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.968 1.707 . . . . 0.0 110.224 168.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.2 m -59.95 -48.98 79.5 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.652 0.781 . . . . 0.0 112.989 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.15 -10.16 59.5 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 173.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.46 -33.31 39.45 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.84 1.209 . . . . 0.0 113.175 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -98.02 -19.64 17.88 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 96.1 m -130.73 145.03 51.84 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.435 1.094 . . . . 0.0 112.687 -175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 mmp_? -99.45 162.22 13.16 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.38 2.272 . . . . 0.0 110.561 169.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 94.99 -145.27 17.64 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-O 118.974 -0.903 . . . . 0.0 112.101 -178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -140.7 -53.4 0.49 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.106 1.453 . . . . 0.0 114.724 -169.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -70.63 -32.53 49.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.818 0.847 . . . . 0.0 110.436 175.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.0 p -54.12 -54.74 35.46 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 125.97 1.708 . . . . 0.0 111.854 168.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -62.86 -42.14 99.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.628 1.171 . . . . 0.0 111.92 178.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.69 -28.47 60.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -175.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -65.77 -30.57 71.24 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.159 -1.588 . . . . 0.0 110.197 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.0 t -70.22 -25.58 63.46 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.657 -0.652 . . . . 0.0 111.689 176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 mt -75.38 -29.45 59.86 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 176.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.7 -32.9 11.16 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.045 0.938 . . . . 0.0 113.359 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -137.91 10.37 2.85 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.946 1.299 . . . . 0.0 113.755 -162.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.0 m 63.43 7.45 2.98 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.893 2.553 . . . . 0.0 117.893 174.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.6 mtm105 -131.87 159.97 37.06 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.26 1.424 . . . . 0.0 111.645 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 m -78.54 159.01 28.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 118.257 0.481 . . . . 0.0 110.236 158.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 15.2 tt -86.46 60.53 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 123.522 1.629 . . . . 0.0 114.653 -156.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 128.307 2.643 . . . . 0.0 112.516 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.084 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.1 t -54.66 130.92 42.1 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.621 1.168 . . . . 0.0 112.883 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.15 3.59 72.66 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 117.751 1.86 . . . . 0.0 117.751 164.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.9 m -134.04 62.42 1.65 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.52 1.528 . . . . 0.0 111.371 -169.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.76 154.66 88.3 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.052 1.341 . . . . 0.0 112.854 -178.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.33 -40.67 65.96 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.36 2.04 . . . . 0.0 113.611 -178.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -69.42 -7.04 34.19 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 174.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -96.68 -43.58 7.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 111.074 166.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 89.6 m -61.37 -30.9 70.82 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.853 -1.155 . . . . 0.0 113.661 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.76 -5.06 54.56 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.803 1.409 . . . . 0.0 114.803 172.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.54 -27.34 15.16 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.738 1.161 . . . . 0.0 113.477 163.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -88.05 -28.84 21.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 177.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 60.5 m -131.43 149.9 52.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.631 1.173 . . . . 0.0 112.873 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -110.81 135.16 51.8 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.311 1.444 . . . . 0.0 110.715 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.34 -145.07 18.63 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 125.258 1.409 . . . . 0.0 112.713 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -137.99 -44.77 0.52 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.073 1.349 . . . . 0.0 112.911 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.85 -41.0 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.359 1.064 . . . . 0.0 109.978 170.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -59.79 -43.26 94.51 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.88 0.872 . . . . 0.0 112.419 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -66.16 -27.51 68.07 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.672 1.189 . . . . 0.0 113.756 175.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -78.75 -36.16 43.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 119.584 1.083 . . . . 0.0 113.28 167.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.05 -43.92 95.04 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.416 -1.428 . . . . 0.0 111.03 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.8 t -58.37 -27.2 63.99 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.558 1.143 . . . . 0.0 113.642 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -62.4 -29.04 70.2 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.908 1.231 . . . . 0.0 113.563 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -111.0 -38.74 4.99 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.131 0.972 . . . . 0.0 113.054 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -92.58 -22.66 19.38 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -171.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.7 m 55.8 21.43 4.74 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.703 1.601 . . . . 0.0 115.091 -173.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -117.09 170.7 8.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.733 2.013 . . . . 0.0 109.485 161.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 m -77.31 174.1 11.16 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 155.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.263 14.4 tt -65.34 96.24 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 O-C-N 120.774 -1.204 . . . . 0.0 113.904 -167.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 128.046 2.538 . . . . 0.0 111.65 172.336 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.117 0 N-CA-C 110.181 -1.167 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.9 m -123.91 12.96 9.13 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.717 1.207 . . . . 0.0 113.73 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -55.16 146.83 28.03 Favored Glycine 0 CA--C 1.534 1.245 0 O-C-N 121.408 -0.808 . . . . 0.0 112.591 173.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 p -137.99 31.83 2.44 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -171.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 60.0 mtm -70.91 147.44 94.05 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.457 0.703 . . . . 0.0 110.429 159.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -53.83 -44.24 50.93 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.514 2.809 . . . . 0.0 115.078 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pm0 -74.63 -8.54 56.69 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -91.88 -42.1 10.24 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.734 1.614 . . . . 0.0 110.482 167.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 93.8 m -59.64 -46.32 89.36 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 124.183 0.993 . . . . 0.0 112.138 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.31 -16.16 61.89 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.07 -27.55 70.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.727 -1.041 . . . . 0.0 113.135 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -104.46 -35.7 7.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 115.775 1.768 . . . . 0.0 115.775 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.1 m -106.1 146.61 29.96 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.015 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -117.82 137.53 52.7 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.957 1.303 . . . . 0.0 111.504 -171.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.15 -156.53 25.26 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 123.725 0.678 . . . . 0.0 111.946 -161.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -116.49 -46.94 2.75 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 0.0 112.216 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 t -60.99 -35.79 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.735 0.814 . . . . 0.0 110.964 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 82.6 p -66.09 -45.17 82.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.786 1.234 . . . . 0.0 112.752 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -63.63 -43.5 96.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.217 1.007 . . . . 0.0 110.461 173.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -64.07 -29.16 70.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.363 1.065 . . . . 0.0 113.437 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -70.87 -37.13 73.05 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.147 -0.971 . . . . 0.0 110.356 175.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 37.2 t -64.42 -34.59 78.53 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 120.96 -1.088 . . . . 0.0 111.374 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.72 -34.81 73.39 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -119.72 2.1 11.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.196 1.398 . . . . 0.0 114.012 -168.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -145.17 -15.27 0.51 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.909 1.283 . . . . 0.0 114.121 -177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 58.0 m 58.76 37.78 24.94 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.902 1.281 . . . . 0.0 114.032 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 54.1 mtp85 -141.76 161.52 37.75 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.64 2.376 . . . . 0.0 110.327 171.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -86.11 135.53 33.57 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.807 0.73 . . . . 0.0 110.122 164.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 2.7 tt -64.77 131.86 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 O-C-N 121.261 -0.899 . . . . 0.0 110.165 173.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.591 0.756 . . . . 0.0 112.504 -174.659 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.975 0 CA-C-O 119.073 -0.849 . . . . 0.0 111.381 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -131.89 165.76 23.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.998 2.119 . . . . 0.0 110.845 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.07 -146.22 25.11 Favored Glycine 0 N--CA 1.47 0.946 0 O-C-N 121.431 -0.793 . . . . 0.0 111.52 -169.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 78.7 m -74.95 48.45 0.39 Allowed 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.654 -1.498 . . . . 0.0 113.77 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 52.9 mtt -110.88 150.34 41.7 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.418 1.887 . . . . 0.0 113.089 -175.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.71 -35.88 94.0 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.548 2.832 . . . . 0.0 115.755 -175.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -71.95 -36.47 69.89 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.459 0.704 . . . . 0.0 111.944 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.22 -37.2 77.9 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.595 -0.69 . . . . 0.0 111.152 175.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.8 m -61.7 -54.68 39.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.484 0.714 . . . . 0.0 111.603 174.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.66 60.29 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.67 2.48 39.72 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.803 1.192 . . . . 0.0 115.731 172.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -143.34 -39.15 0.32 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.291 1.545 . . . . 0.0 114.259 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 83.0 m -94.67 141.56 28.47 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.167 0.987 . . . . 0.0 111.222 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -104.11 159.24 15.84 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 112.731 -164.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.05 -135.03 12.83 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.503 1.525 . . . . 0.0 113.711 175.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.1 tttp -132.76 -45.47 0.88 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.349 1.46 . . . . 0.0 112.912 174.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -61.82 -39.93 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.038 0.835 . . . . 0.0 112.087 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.1 t -76.61 -38.85 54.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.632 0.773 . . . . 0.0 112.316 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -56.71 -50.66 71.5 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.429 -0.794 . . . . 0.0 111.189 168.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -58.86 -29.25 66.82 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.945 1.698 . . . . 0.0 113.212 173.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -68.33 -43.34 77.76 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.082 -1.011 . . . . 0.0 110.862 174.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.39 -26.58 66.52 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 176.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -62.75 -26.68 68.82 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 120.973 -1.079 . . . . 0.0 113.612 171.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -102.56 -38.34 7.57 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.921 1.289 . . . . 0.0 113.605 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -118.51 -14.0 9.69 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -161.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.8 t 56.66 -11.75 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.588 2.355 . . . . 0.0 116.979 -172.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 21.3 mtm180 -75.16 167.27 22.24 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.758 -1.214 . . . . 0.0 109.489 151.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.0 m -98.86 164.02 12.37 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.262 1.025 . . . . 0.0 109.937 159.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.0 tt -70.39 108.95 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 O-C-N 121.245 -0.909 . . . . 0.0 113.442 -163.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 125.528 1.531 . . . . 0.0 114.193 -164.81 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.268 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -73.53 63.88 0.84 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.411 1.884 . . . . 0.0 111.609 173.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.87 -176.13 50.64 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 123.745 0.688 . . . . 0.0 111.911 -152.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 12.5 m 53.49 79.37 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.127 1.771 . . . . 0.0 110.856 -171.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 21.2 mmt -94.72 159.22 33.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.448 1.499 . . . . 0.0 112.161 -172.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -58.54 -35.91 98.05 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.038 1.825 . . . . 0.0 114.496 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -34.49 74.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.287 1.035 . . . . 0.0 113.442 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.14 -48.87 18.98 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.085 1.354 . . . . 0.0 110.756 170.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.1 m -63.87 -39.44 94.21 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.65 -5.5 53.15 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 174.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.68 -23.96 24.61 Favored Glycine 0 CA--C 1.538 1.528 0 C-N-CA 125.093 1.33 . . . . 0.0 113.456 165.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -81.44 -42.85 19.75 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.504 1.122 . . . . 0.0 112.745 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 91.1 m -135.88 147.81 48.35 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.518 1.127 . . . . 0.0 113.41 -162.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -114.89 147.88 39.35 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.916 1.687 . . . . 0.0 110.415 -169.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.51 -142.44 16.16 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 -164.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -144.05 -43.01 0.26 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.581 1.191 . . . . 0.0 113.646 -178.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.8 t -60.55 -37.6 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.421 0.688 . . . . 0.0 110.964 172.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.2 p -61.55 -44.65 96.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.943 1.297 . . . . 0.0 112.388 172.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -63.07 -48.46 78.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.821 178.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.39 -33.35 71.1 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.352 1.461 . . . . 0.0 112.904 174.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.99 -40.52 91.27 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.933 -1.104 . . . . 0.0 110.608 177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 15.2 t -65.38 -35.57 81.36 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.562 0.745 . . . . 0.0 112.835 173.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.12 -36.17 67.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.577 1.08 . . . . 0.0 112.338 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -99.54 -35.87 9.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.988 1.315 . . . . 0.0 113.952 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -126.81 -1.3 6.65 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.415 1.086 . . . . 0.0 113.508 -166.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 58.58 -22.62 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 129.001 2.92 . . . . 0.0 117.84 -175.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -69.88 174.2 5.52 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.012 1.725 . . . . 0.0 109.837 163.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.74 158.55 19.95 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 111.03 161.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.6 tt -58.32 146.62 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.05 1.34 . . . . 0.0 113.622 -173.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 . . . . . 0 C--O 1.248 1.003 0 C-N-CA 126.091 1.756 . . . . 0.0 111.211 174.683 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -129.9 162.55 28.32 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.202 1.401 . . . . 0.0 112.777 -170.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.95 -127.88 9.24 Favored Glycine 0 N--CA 1.474 1.192 0 O-C-N 121.43 -0.793 . . . . 0.0 114.05 172.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.7 m -85.34 21.94 1.62 Allowed 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.704 1.252 . . . . 0.0 113.613 175.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 87.6 mtp -79.01 136.05 58.16 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 124.061 0.944 . . . . 0.0 110.749 176.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -53.03 -42.55 63.78 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.632 2.888 . . . . 0.0 114.886 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.68 -27.91 69.57 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.74 1.216 . . . . 0.0 113.986 176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -80.92 -38.03 28.57 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 111.687 174.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.7 m -54.1 -48.05 71.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.317 0.647 . . . . 0.0 111.145 170.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.09 -27.91 61.12 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.6 -38.41 78.37 Favored Glycine 0 CA--C 1.536 1.346 0 O-C-N 121.346 -0.847 . . . . 0.0 113.573 173.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -85.06 -28.32 25.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.635 1.174 . . . . 0.0 113.716 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.1 m -126.61 138.96 53.51 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.396 0.998 . . . . 0.0 113.095 -166.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -98.56 137.28 37.45 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.021 1.728 . . . . 0.0 111.998 -170.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 104.14 -139.51 14.58 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.221 0.915 . . . . 0.0 112.416 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -136.88 -51.72 0.68 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.795 1.638 . . . . 0.0 112.819 -174.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.35 -38.51 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 0.0 110.827 174.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 86.5 p -58.51 -45.6 88.46 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.937 0.895 . . . . 0.0 112.512 174.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -62.91 -51.09 68.32 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.567 1.547 . . . . 0.0 110.553 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -64.62 -26.41 68.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.405 1.482 . . . . 0.0 113.801 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -62.99 -42.93 99.98 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.566 -1.334 . . . . 0.0 110.333 170.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -70.58 -33.12 70.73 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.662 -0.649 . . . . 0.0 111.629 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.4 mt -60.23 -29.7 68.93 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 175.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mtmm -112.3 -22.33 10.96 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -130.94 -9.05 3.91 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.959 1.304 . . . . 0.0 113.557 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.284 7.8 t 47.57 40.06 10.87 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.512 1.925 . . . . 0.0 114.405 -172.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -136.03 159.9 40.28 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.615 2.366 . . . . 0.0 109.371 164.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.44 147.9 24.26 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.488 0.585 . . . . 0.0 111.13 163.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.4 tt -69.36 120.95 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 124.937 1.295 . . . . 0.0 111.52 -167.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 C--O 1.253 1.259 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -173.041 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.997 0 CA-C-O 119.818 -0.434 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.1 p -149.77 -12.42 0.28 Allowed 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 164.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.98 -179.21 38.82 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 125.631 1.586 . . . . 0.0 112.776 169.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 56.5 m -78.46 63.17 3.25 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.269 1.027 . . . . 0.0 112.785 -173.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.7 mtp -96.3 145.02 28.84 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 126.734 2.013 . . . . 0.0 111.556 173.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -56.04 -39.35 91.73 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.587 2.192 . . . . 0.0 114.564 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -69.47 -25.97 64.34 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 176.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -71.39 -45.07 63.71 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.121 -0.987 . . . . 0.0 110.705 170.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 81.0 m -58.06 -49.74 75.87 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.403 0.681 . . . . 0.0 112.528 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.71 -22.22 43.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.23 -28.69 72.46 Favored Glycine 0 CA--C 1.529 0.926 0 CA-C-O 118.748 -1.029 . . . . 0.0 113.518 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -103.44 -37.41 7.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.184 1.492 . . . . 0.0 114.371 175.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.47 144.29 37.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.181 1.355 . . . . 0.0 113.288 -169.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -113.56 137.47 51.52 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.056 1.342 . . . . 0.0 111.089 -165.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.08 -160.97 17.53 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.056 0.836 . . . . 0.0 112.695 -168.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -114.69 -44.13 3.09 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.665 1.586 . . . . 0.0 111.146 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.93 -38.78 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.485 0.714 . . . . 0.0 111.556 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.8 p -63.62 -48.01 79.02 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 125.224 1.409 . . . . 0.0 112.194 176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.32 -46.91 86.61 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.872 1.269 . . . . 0.0 111.333 175.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.44 -23.2 64.58 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.841 0.856 . . . . 0.0 113.023 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.32 -36.26 83.51 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.471 -1.393 . . . . 0.0 109.953 168.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.5 t -78.47 -35.3 46.84 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.461 -0.774 . . . . 0.0 112.088 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.7 mt -59.16 -40.13 84.62 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.03 0.832 . . . . 0.0 112.02 173.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -93.6 -30.87 14.74 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -139.8 3.94 2.08 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -164.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.281 4.3 t 50.83 19.18 0.59 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 128.025 2.53 . . . . 0.0 117.215 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.1 mmt-85 -111.48 168.46 9.53 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.475 1.51 . . . . 0.0 109.181 163.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -99.07 160.98 13.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.496 0.665 . . . . 0.0 111.122 163.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 14.7 tt -69.68 128.92 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 121.643 -0.66 . . . . 0.0 111.061 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.3 mtm180 . . . . . 0 C--O 1.252 1.23 0 C-N-CA 127.8 2.44 . . . . 0.0 109.355 -179.489 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.099 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -136.02 19.34 3.23 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.969 1.307 . . . . 0.0 114.317 177.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.08 145.41 4.53 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.343 1.449 . . . . 0.0 112.14 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 79.5 m -118.3 8.13 12.17 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -174.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 mmt -70.06 143.41 91.47 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.361 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_exo -55.61 -40.47 85.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.404 2.736 . . . . 0.0 116.32 -171.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.8 mp0 -72.11 -29.12 63.77 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.465 1.106 . . . . 0.0 112.527 175.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -81.63 -29.74 33.11 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.056 1.343 . . . . 0.0 112.109 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 92.2 m -57.09 -42.87 81.53 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.079 -1.013 . . . . 0.0 110.546 164.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.03 -2.81 38.96 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 176.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.5 -50.73 3.91 Favored Glycine 0 CA--C 1.534 1.235 0 O-C-N 121.314 -0.866 . . . . 0.0 111.61 164.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.45 -33.29 74.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.721 0.808 . . . . 0.0 113.054 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.4 m -136.87 144.1 43.39 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 0.0 112.641 -165.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -132.11 142.31 49.46 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.306 -0.871 . . . . 0.0 112.42 -168.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.18 -152.71 18.0 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.539 1.542 . . . . 0.0 111.323 -165.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -118.9 -45.41 2.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.932 1.693 . . . . 0.0 112.019 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.14 -36.42 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.185 1.394 . . . . 0.0 111.143 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 64.4 p -57.97 -45.83 86.1 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.118 0.967 . . . . 0.0 111.856 171.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -66.21 -47.73 72.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.316 1.046 . . . . 0.0 111.821 174.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -57.93 -32.16 67.52 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.185 1.394 . . . . 0.0 114.07 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -69.03 -34.07 74.63 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.928 174.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 48.1 t -77.56 -29.22 52.05 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.081 -1.012 . . . . 0.0 111.931 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.69 -38.69 91.4 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -98.96 -28.19 13.53 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -173.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -139.94 -1.43 1.59 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -166.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.9 t 44.21 57.93 4.01 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.573 1.549 . . . . 0.0 113.334 -171.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -139.78 167.66 21.6 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 128.918 2.887 . . . . 0.0 108.696 170.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 73.4 m -128.33 144.99 51.2 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.395 0.678 . . . . 0.0 111.312 170.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.2 tt -83.7 133.92 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.425 0.69 . . . . 0.0 112.826 -165.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 . . . . . 0 C--O 1.248 1.0 0 C-N-CA 127.674 2.389 . . . . 0.0 111.731 178.115 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.954 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -142.81 171.79 13.57 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 0.0 111.928 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.77 -122.01 6.92 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 121.493 -0.754 . . . . 0.0 113.447 172.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 30.49 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 126.767 2.027 . . . . 0.0 116.309 -174.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 59.7 mtt -112.61 144.13 30.34 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 127.947 2.499 . . . . 0.0 111.922 -176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.6 -38.78 92.45 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.418 2.078 . . . . 0.0 115.079 -169.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -68.68 -30.61 69.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 114.286 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -82.52 -33.42 28.25 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.081 0.855 . . . . 0.0 110.792 173.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.2 m -65.49 -31.47 72.56 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.054 0.942 . . . . 0.0 113.27 176.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -98.43 17.0 19.94 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.232 1.413 . . . . 0.0 114.07 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.86 -40.09 85.05 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.767 1.175 . . . . 0.0 113.597 173.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.6 mm-40 -128.08 7.04 6.0 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.04 1.736 . . . . 0.0 113.637 -178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 71.2 m -137.12 139.24 41.07 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.711 1.604 . . . . 0.0 112.012 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -111.79 174.39 5.9 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.577 1.951 . . . . 0.0 111.641 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.54 -158.49 39.48 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.425 1.012 . . . . 0.0 113.357 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -113.42 -46.37 3.07 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.767 1.627 . . . . 0.0 111.518 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.3 t -60.92 -45.18 98.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 118.795 0.725 . . . . 0.0 111.771 -171.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -80.09 -38.28 32.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.171 0.588 . . . . 0.0 112.121 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -59.12 -48.39 81.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.41 -0.806 . . . . 0.0 112.065 170.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -22.97 61.51 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.48 1.037 . . . . 0.0 113.345 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.45 ' CD2' ' HA ' ' A' ' 29' ' ' ILE . 23.9 t80 -60.97 -43.67 98.46 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.51 -0.744 . . . . 0.0 109.3 168.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -69.06 -31.11 69.64 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.304 -0.873 . . . . 0.0 112.943 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.06 -24.68 67.24 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 120.029 1.286 . . . . 0.0 113.348 174.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -99.97 -43.7 6.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.837 1.255 . . . . 0.0 113.144 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -114.7 -7.39 12.71 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.423 1.889 . . . . 0.0 114.203 -161.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.6 m 62.18 9.56 3.25 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.089 2.156 . . . . 0.0 116.473 -178.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.0 mtm105 -119.9 162.33 19.35 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 0.0 110.61 172.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.8 m -81.72 147.26 29.56 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.345 0.658 . . . . 0.0 109.779 160.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.45 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 14.4 tt -58.42 -29.48 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 117.256 2.317 . . . . 0.0 117.256 -151.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.363 1.616 . . . . 0.0 115.363 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.895 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.7 m -66.18 -21.38 66.32 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -173.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -160.23 146.01 12.01 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 124.94 1.257 . . . . 0.0 110.961 175.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 14.2 m -134.05 20.6 3.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.408 1.483 . . . . 0.0 113.525 -158.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt -104.65 151.93 39.36 Favored Pre-proline 0 CA--C 1.54 0.591 0 C-N-CA 126.208 1.803 . . . . 0.0 111.256 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -61.34 -35.31 84.63 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 121.68 1.587 . . . . 0.0 115.001 -166.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -77.01 -21.73 54.18 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.421 1.488 . . . . 0.0 113.922 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -81.17 -42.26 21.12 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.229 1.412 . . . . 0.0 109.97 170.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 84.5 m -58.77 -43.35 90.37 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.302 -0.874 . . . . 0.0 112.724 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.96 -12.61 59.97 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.24 -39.28 32.02 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 118.525 0.602 . . . . 0.0 113.136 168.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -94.37 -24.45 17.37 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.9 m -112.59 135.41 53.34 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.026 0.93 . . . . 0.0 112.328 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -104.33 148.53 26.28 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.689 . . . . 0.0 110.508 171.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.67 -160.96 28.09 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.6 1.095 . . . . 0.0 111.929 -162.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -125.8 -45.57 1.75 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.865 1.666 . . . . 0.0 112.206 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.21 -38.45 54.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 118.985 0.812 . . . . 0.0 110.85 173.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -66.34 -46.43 76.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.68 1.592 . . . . 0.0 112.813 176.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -61.52 -43.6 98.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.375 1.07 . . . . 0.0 110.357 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.04 -28.22 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.703 1.201 . . . . 0.0 113.385 174.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.62 -33.23 72.36 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.071 173.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.2 t -72.76 -33.52 66.39 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.689 -1.257 . . . . 0.0 111.633 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.0 mt -59.23 -38.81 80.89 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.882 0.765 . . . . 0.0 112.533 173.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.7 mtmm -102.02 -23.17 14.13 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -136.93 -5.34 1.91 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -170.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t 53.06 41.89 32.19 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.892 1.441 . . . . 0.0 114.892 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -134.06 161.45 34.82 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.109 1.764 . . . . 0.0 109.631 163.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.1 m -84.41 141.66 30.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 153.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 17.2 tt -66.89 125.48 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.278 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 . . . . . 0 N--CA 1.486 1.335 0 C-N-CA 125.012 1.325 . . . . 0.0 113.357 172.958 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.776 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -74.11 166.09 24.01 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.568 1.547 . . . . 0.0 113.744 -177.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.7 152.08 28.47 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 124.157 0.884 . . . . 0.0 113.993 175.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.3 m -119.83 19.83 12.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.247 1.419 . . . . 0.0 113.83 178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.6 mmt -104.09 155.59 36.93 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 125.887 1.675 . . . . 0.0 112.101 -174.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.64 -34.42 92.22 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.367 2.044 . . . . 0.0 115.119 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -72.04 -21.67 61.5 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.235 1.414 . . . . 0.0 114.399 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -80.12 -45.75 17.65 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.385 0.674 . . . . 0.0 109.886 169.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 70.5 m -56.95 -52.03 66.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.922 0.889 . . . . 0.0 111.92 178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.8 -21.06 44.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.39 -22.93 78.57 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 118.928 -0.929 . . . . 0.0 113.916 171.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -116.32 -10.71 11.34 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.811 1.306 . . . . 0.0 114.498 -176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 m -138.35 134.81 34.68 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.695 1.198 . . . . 0.0 111.171 -173.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -99.91 156.34 17.19 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.255 1.422 . . . . 0.0 112.518 -174.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.86 -153.09 29.33 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.292 1.425 . . . . 0.0 112.236 -173.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -125.87 -32.76 2.78 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.574 1.187 . . . . 0.0 113.633 -178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -66.12 -44.22 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.136 0.88 . . . . 0.0 110.106 175.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 t -61.36 -45.78 92.96 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.239 1.415 . . . . 0.0 111.189 177.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.94 -52.38 56.66 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.478 1.111 . . . . 0.0 113.129 175.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.98 -24.53 67.75 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -175.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' A' ' 29' ' ' ILE . 12.4 t80 -65.89 -36.67 84.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.459 -0.776 . . . . 0.0 111.606 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 43.4 t -71.34 -28.36 64.02 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.524 1.13 . . . . 0.0 112.007 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 67.6 mt -66.8 -16.25 64.14 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.89 -12.39 7.54 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -143.13 4.6 1.44 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -171.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t 58.28 -22.24 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 129.435 3.094 . . . . 0.0 118.08 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -77.19 160.56 28.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.777 -1.202 . . . . 0.0 109.994 165.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.4 m -101.95 103.87 14.53 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.642 0.777 . . . . 0.0 110.645 167.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.424 ' H ' ' HB3' ' A' ' 21' ' ' TYR 0.401 9.6 tp 49.52 -23.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 1 C-N-CA 133.075 4.55 . . . . 0.0 119.463 174.264 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.7 1.6 . . . . 0.0 112.774 -176.179 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.201 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.1 m -114.81 169.82 8.79 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.462 1.505 . . . . 0.0 114.285 -170.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -47.66 115.31 2.15 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.52 1.533 . . . . 0.0 116.713 -167.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.0 m 53.53 18.21 1.35 Allowed 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 116.512 2.042 . . . . 0.0 116.512 -176.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 61.0 mtt -83.4 156.36 65.87 Favored Pre-proline 0 N--CA 1.471 0.594 0 C-N-CA 124.543 1.137 . . . . 0.0 110.84 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -54.92 -35.3 88.99 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.677 2.251 . . . . 0.0 113.961 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -68.64 -27.29 65.87 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.69 1.132 . . . . 0.0 113.594 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -74.24 -45.64 46.73 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.426 -0.796 . . . . 0.0 110.713 168.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.96 -47.68 83.79 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.244 -0.91 . . . . 0.0 112.963 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.03 -4.25 56.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.699 1.2 . . . . 0.0 113.433 173.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.81 -46.32 7.26 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.875 1.226 . . . . 0.0 111.435 165.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -72.95 -37.39 67.14 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.824 1.25 . . . . 0.0 113.94 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.3 m -139.3 144.78 38.47 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -160.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.93 163.56 13.97 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.161 2.184 . . . . 0.0 112.694 -176.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.49 -144.88 20.83 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 124.652 1.12 . . . . 0.0 112.085 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -136.18 -37.66 0.71 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.681 1.192 . . . . 0.0 112.371 -172.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 58.0 t -66.99 -47.57 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.215 1.006 . . . . 0.0 111.455 175.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -72.09 -39.63 68.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.638 0.775 . . . . 0.0 112.191 -174.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -55.6 -47.39 76.57 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.958 0.503 . . . . 0.0 111.045 169.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.31 -29.53 70.83 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.917 1.287 . . . . 0.0 113.802 174.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -64.2 -40.38 95.96 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.845 -1.159 . . . . 0.0 110.319 175.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.4 t -68.8 -29.95 68.41 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.299 0.639 . . . . 0.0 112.514 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.0 mt -61.95 -28.02 69.25 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.087 -1.008 . . . . 0.0 113.458 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -118.62 -29.3 5.45 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -102.76 -15.19 16.35 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.5 1.52 . . . . 0.0 112.626 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . 0.282 8.5 t 51.22 32.12 7.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.121 1.768 . . . . 0.0 114.624 -169.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -131.36 161.32 32.65 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.703 1.601 . . . . 0.0 109.388 168.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 67.6 m -78.47 158.29 28.68 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 161.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.6 tt -71.59 98.2 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 121.039 -1.038 . . . . 0.0 112.418 -174.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 . . . . . 0 N--CA 1.474 0.734 0 C-N-CA 126.961 2.104 . . . . 0.0 111.872 178.2 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.6 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -96.08 -19.46 19.4 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.127 0.971 . . . . 0.0 112.468 164.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.4 127.55 9.07 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.173 0.892 . . . . 0.0 113.209 176.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.3 p -151.76 44.6 0.76 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.249 1.42 . . . . 0.0 112.61 172.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 154.06 92.49 Favored Pre-proline 0 N--CA 1.473 0.688 0 C-N-CA 123.777 0.831 . . . . 0.0 111.285 161.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.44 -42.73 45.78 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 122.245 1.963 . . . . 0.0 115.139 -166.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -68.83 -26.48 65.19 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.633 -0.667 . . . . 0.0 112.7 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -88.69 -33.11 17.67 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.416 1.486 . . . . 0.0 112.061 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 94.3 m -57.16 -40.69 77.78 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.116 -0.99 . . . . 0.0 111.325 165.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.22 -1.88 42.5 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.407 1.632 . . . . 0.0 115.407 177.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -92.33 -50.98 2.47 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.292 0.949 . . . . 0.0 112.151 164.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -76.42 -26.58 55.65 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.4 m -118.04 140.79 49.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.552 1.541 . . . . 0.0 111.412 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -114.47 142.68 46.06 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.208 1.403 . . . . 0.0 111.291 -174.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 100.46 -133.7 11.41 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 125.065 1.317 . . . . 0.0 113.462 -171.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.46 -53.1 0.83 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.006 1.322 . . . . 0.0 111.918 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.69 -34.68 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 123.863 0.865 . . . . 0.0 111.919 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 95.9 p -63.31 -44.16 95.77 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.433 1.093 . . . . 0.0 112.469 170.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.94 -43.15 83.95 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.279 1.031 . . . . 0.0 111.062 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.253 0.5 OUTLIER -70.53 -21.58 62.71 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.981 1.264 . . . . 0.0 113.399 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -68.76 -32.71 72.66 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.047 -1.033 . . . . 0.0 111.296 166.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 t -76.17 -33.05 59.35 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.973 -1.079 . . . . 0.0 111.73 173.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.51 -40.22 96.48 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.258 -0.901 . . . . 0.0 112.681 172.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -91.76 -39.73 11.63 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -128.03 3.72 5.89 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.934 1.294 . . . . 0.0 113.427 -164.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.3 t 63.72 10.96 5.46 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.0 mtm-85 -118.61 169.89 9.42 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.798 1.639 . . . . 0.0 111.4 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 39.6 m -79.52 162.33 25.46 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 157.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.302 16.3 tt -81.41 78.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-O 123.968 1.842 . . . . 0.0 113.024 -173.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.008 2.123 . . . . 0.0 108.661 168.32 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.154 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -78.44 163.3 25.73 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.218 1.807 . . . . 0.0 112.779 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.2 -157.74 14.81 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 125.466 1.508 . . . . 0.0 111.699 -174.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 57.45 3.6 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.599 -1.53 . . . . 0.0 111.345 173.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.1 mmt -111.37 141.91 25.39 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 111.499 -170.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -52.47 -37.52 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.396 2.73 . . . . 0.0 115.506 -178.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -68.8 -27.29 65.73 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.649 1.58 . . . . 0.0 114.426 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -82.74 -35.63 26.48 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.334 1.054 . . . . 0.0 110.145 173.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 76.4 m -59.12 -49.62 77.16 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.388 1.075 . . . . 0.0 112.566 174.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.31 5.35 15.01 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 173.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.58 -62.06 1.82 Allowed Glycine 0 CA--C 1.533 1.206 0 O-C-N 121.504 -0.748 . . . . 0.0 111.274 156.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -72.17 -26.78 62.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.055 1.742 . . . . 0.0 115.261 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.0 m -121.82 148.94 44.05 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.868 1.267 . . . . 0.0 112.297 -170.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -121.29 140.32 52.23 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.202 1.801 . . . . 0.0 110.316 -176.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.59 162.74 33.82 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 123.511 0.577 . . . . 0.0 113.159 -170.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.9 tttp -82.47 -39.95 21.8 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.99 1.316 . . . . 0.0 110.689 -164.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.03 -39.12 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 124.861 1.264 . . . . 0.0 111.308 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.5 t -72.15 -43.36 64.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 118.891 0.769 . . . . 0.0 111.971 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -58.29 -42.69 87.13 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.31 -0.869 . . . . 0.0 111.651 168.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -66.94 -23.86 66.01 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 173.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -69.63 -36.1 75.83 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.18 -1.575 . . . . 0.0 110.654 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.8 t -71.34 -33.1 69.31 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.806 -0.559 . . . . 0.0 111.713 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.3 mt -58.25 -39.09 78.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.04 0.837 . . . . 0.0 112.521 174.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -105.45 -26.28 12.0 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -168.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -135.17 5.47 3.28 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 125.225 1.41 . . . . 0.0 113.092 -171.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.8 m 54.64 28.08 9.49 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 116.273 1.953 . . . . 0.0 116.273 175.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -132.27 166.49 21.77 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.309 1.844 . . . . 0.0 110.88 171.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 m -70.18 163.62 25.97 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 151.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . 0.276 11.8 tt -58.34 97.05 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -169.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 . . . . . 0 C--O 1.25 1.13 0 C-N-CA 128.01 2.524 . . . . 0.0 111.252 -173.777 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.263 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 p -68.84 108.3 3.4 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.002 0.906 . . . . 0.0 110.219 170.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.6 8.29 62.47 Favored Glycine 0 CA--C 1.534 1.256 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.5 p -152.2 117.09 5.14 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.035 1.334 . . . . 0.0 112.243 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 76.4 mtm -84.34 157.32 62.13 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.733 1.213 . . . . 0.0 112.822 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.88 -36.53 98.17 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.033 2.489 . . . . 0.0 113.61 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.18 -27.74 68.91 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.912 1.285 . . . . 0.0 114.115 177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -74.8 -48.74 23.73 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.174 0.99 . . . . 0.0 110.59 166.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 72.6 m -57.69 -43.07 84.86 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.41 -11.35 59.94 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 176.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.55 -41.7 10.99 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.577 1.084 . . . . 0.0 112.65 166.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.4 mm-40 -76.65 -26.72 55.18 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 118.576 1.188 . . . . 0.0 113.327 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 68.5 m -142.14 145.95 34.78 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -165.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -118.46 148.81 42.2 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.528 1.931 . . . . 0.0 112.414 -171.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 101.52 -138.46 13.89 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.654 1.121 . . . . 0.0 112.466 -170.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -132.36 -51.55 0.94 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 126.487 1.915 . . . . 0.0 112.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.9 t -70.73 -31.8 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.599 0.76 . . . . 0.0 111.239 -173.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.4 p -60.34 -53.23 60.08 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.431 1.492 . . . . 0.0 111.877 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -58.39 -47.95 82.21 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.359 1.464 . . . . 0.0 111.587 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -62.29 -28.38 69.68 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.113 1.765 . . . . 0.0 113.67 178.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -71.06 -39.05 72.47 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.096 -1.003 . . . . 0.0 110.327 172.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.28 -33.09 74.57 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.347 -0.845 . . . . 0.0 111.803 176.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.1 mt -61.09 -28.74 69.3 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.982 -1.074 . . . . 0.0 113.283 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -103.41 -20.17 14.16 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -148.09 3.15 0.69 Allowed 'General case' 0 CA--C 1.555 1.136 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 -170.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.4 m 56.66 -13.38 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 118.319 2.711 . . . . 0.0 118.319 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -76.34 172.14 13.39 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.099 1.318 . . . . 0.0 109.887 159.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.6 m -110.72 159.72 17.36 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.821 0.848 . . . . 0.0 111.252 161.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 16.4 tt -66.71 128.6 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -170.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? . . . . . 0 C--O 1.255 1.37 0 C-N-CA 128.74 2.816 . . . . 0.0 110.406 175.959 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.876 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.5 m -97.9 162.36 13.28 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.642 0.777 . . . . 0.0 112.845 -173.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.56 -126.28 8.19 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.524 0.583 . . . . 0.0 113.365 168.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 59.1 m -78.24 61.14 2.66 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.917 1.287 . . . . 0.0 113.645 -168.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 50.0 mtt -136.66 121.18 12.64 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 127.458 2.303 . . . . 0.0 109.206 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.61 -37.24 95.45 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.754 2.303 . . . . 0.0 113.869 -177.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.5 -8.05 55.73 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -84.64 -46.02 11.92 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.101 0.96 . . . . 0.0 109.361 163.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.3 m -56.26 -59.65 4.64 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.318 1.047 . . . . 0.0 112.513 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.06 -0.09 26.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.87 -26.02 54.54 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.774 1.178 . . . . 0.0 114.011 169.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -125.57 -22.1 4.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.6 134.48 53.14 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.718 1.145 . . . . 0.0 111.054 -174.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.3 mmt180 -115.24 143.59 45.02 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.411 1.484 . . . . 0.0 110.535 -164.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.03 -141.93 15.45 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 124.214 0.912 . . . . 0.0 112.876 -173.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -127.73 -45.87 1.44 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.959 1.304 . . . . 0.0 112.617 176.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -63.92 -39.07 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 119.374 0.988 . . . . 0.0 112.253 -177.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.9 p -63.8 -48.09 78.25 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.592 1.157 . . . . 0.0 111.983 175.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -59.56 -52.34 65.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.066 1.346 . . . . 0.0 111.486 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -56.96 -34.32 67.93 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.285 1.834 . . . . 0.0 113.189 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -67.36 -36.81 82.14 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 121.271 -0.893 . . . . 0.0 110.536 173.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.9 t -76.83 -31.55 56.98 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.011 -1.056 . . . . 0.0 112.561 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.63 -34.28 75.41 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.378 0.99 . . . . 0.0 111.816 172.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -87.23 -44.43 11.46 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 174.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -118.16 -5.59 10.91 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.815 1.246 . . . . 0.0 114.065 -160.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.0 m 60.84 20.9 11.09 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.884 2.073 . . . . 0.0 115.881 178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -137.33 170.49 15.99 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 129.267 3.027 . . . . 0.0 108.018 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 74.2 m -107.38 142.42 37.23 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.87 1.668 . . . . 0.0 112.11 173.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 18.1 tt -52.59 134.11 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 125.374 1.47 . . . . 0.0 113.212 -169.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? . . . . . 0 C--O 1.25 1.09 0 CA-C-O 116.658 -1.639 . . . . 0.0 111.61 170.399 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.421 ' HA3' ' SD ' ' A' ' 5' ' ' MET . . . . . . . . 0 N--CA 1.471 0.976 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -69.44 148.58 49.38 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.448 1.099 . . . . 0.0 113.304 -173.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.28 -167.08 40.92 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.647 1.118 . . . . 0.0 113.828 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 59.6 m -77.79 56.22 1.49 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.192 1.797 . . . . 0.0 111.933 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.421 ' SD ' ' HA3' ' A' ' 1' ' ' GLY . 39.2 mtt -71.36 160.87 81.26 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.906 1.283 . . . . 0.0 111.206 170.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -59.06 -34.25 98.86 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.805 1.67 . . . . 0.0 115.442 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -63.58 -41.17 98.4 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.009 1.277 . . . . 0.0 112.91 176.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -63.49 -46.92 83.92 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.973 0.909 . . . . 0.0 110.47 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 85.0 m -67.14 -38.13 85.0 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.996 0.918 . . . . 0.0 113.243 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.0 -7.13 57.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.34 -44.42 9.62 Favored Glycine 0 CA--C 1.534 1.248 0 C-N-CA 123.65 0.643 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -78.7 -33.97 46.43 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.2 m -113.98 158.44 21.16 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.914 1.285 . . . . 0.0 112.768 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 87.0 mmt-85 -119.83 147.3 44.83 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.284 1.434 . . . . 0.0 110.524 170.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.95 -155.79 20.04 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.89 1.233 . . . . 0.0 111.629 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -129.13 -42.86 1.34 Allowed 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.431 1.115 . . . . 0.0 112.656 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -64.82 -36.6 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.297 0.953 . . . . 0.0 110.906 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.7 p -59.29 -43.31 92.57 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.08 0.952 . . . . 0.0 112.49 172.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -65.97 -45.62 81.04 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.044 1.338 . . . . 0.0 111.006 175.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.04 -33.37 75.58 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.799 1.24 . . . . 0.0 113.66 175.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -67.93 -38.93 83.49 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 120.639 -1.288 . . . . 0.0 110.513 175.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.0 t -65.64 -31.48 72.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.404 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.4 mt -57.69 -32.16 67.07 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.716 1.144 . . . . 0.0 112.963 177.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -104.22 -33.13 8.81 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.167 1.787 . . . . 0.0 114.367 -175.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -123.76 -3.47 8.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.639 1.176 . . . . 0.0 113.552 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 79.8 m 57.13 13.77 1.75 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -175.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -115.77 160.24 20.37 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 126.093 1.757 . . . . 0.0 110.89 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 m -74.9 155.56 37.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 159.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 19.2 tt -70.56 111.1 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 O-C-N 121.364 -0.835 . . . . 0.0 111.898 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 . . . . . 0 C--O 1.249 1.073 0 C-N-CA 128.641 2.776 . . . . 0.0 110.479 174.366 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.731 0 N-CA-C 111.141 -0.783 . . . . 0.0 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 p -112.2 110.72 21.13 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.702 2.001 . . . . 0.0 111.22 -172.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 154.84 -170.88 33.15 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 126.26 1.886 . . . . 0.0 112.771 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 33.9 m -80.96 54.34 2.18 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.0 1.32 . . . . 0.0 110.537 174.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 44.0 mtt -84.71 151.61 58.56 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.705 2.002 . . . . 0.0 111.256 -171.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -62.11 -34.64 79.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.389 1.393 . . . . 0.0 114.5 -170.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -78.26 -14.03 59.61 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -83.9 -42.24 16.56 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.127 0.971 . . . . 0.0 110.513 165.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 87.5 m -62.57 -41.57 99.01 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.38 -0.825 . . . . 0.0 112.488 177.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.29 -5.45 49.48 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 170.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.18 -31.6 27.98 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.529 1.061 . . . . 0.0 113.178 167.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -106.9 -19.66 13.57 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.3 137.29 54.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.82 1.248 . . . . 0.0 111.049 -175.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -106.18 146.44 30.26 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.859 1.264 . . . . 0.0 110.661 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.0 -143.95 16.98 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 123.954 0.787 . . . . 0.0 112.249 -168.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -139.42 -43.84 0.45 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.612 1.165 . . . . 0.0 113.223 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.2 t -64.11 -37.43 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.657 0.783 . . . . 0.0 110.145 174.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 91.6 p -61.78 -45.43 93.9 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.976 1.31 . . . . 0.0 112.989 174.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -61.95 -48.22 81.39 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.396 1.479 . . . . 0.0 110.816 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -60.99 -30.16 70.12 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.997 1.319 . . . . 0.0 113.549 175.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -69.96 -41.39 74.58 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.088 -1.007 . . . . 0.0 110.199 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 23.1 t -62.97 -35.35 79.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.295 -0.86 . . . . 0.0 112.606 176.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.79 -38.81 67.76 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.587 0.708 . . . . 0.0 111.968 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -91.51 -53.55 4.27 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.923 1.289 . . . . 0.0 111.624 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -103.86 -1.96 26.99 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.741 1.616 . . . . 0.0 114.574 -162.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 81.5 m 56.28 30.21 16.3 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.119 1.368 . . . . 0.0 114.486 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -139.2 160.1 40.6 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.061 2.144 . . . . 0.0 111.002 176.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -82.87 137.17 34.36 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 162.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 10.7 tt -61.14 147.16 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 122.005 -0.435 . . . . 0.0 111.663 -176.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.248 0 C-N-CA 125.158 1.383 . . . . 0.0 113.618 -177.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.12 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.3 p -138.18 167.54 21.62 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.344 1.058 . . . . 0.0 113.141 -175.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 169.79 -171.58 43.38 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.34 0.971 . . . . 0.0 111.966 177.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 46.8 t -77.03 62.44 2.16 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.896 1.278 . . . . 0.0 111.892 178.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 28.7 mtt -74.13 136.24 76.15 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 125.87 1.668 . . . . 0.0 111.526 -177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -56.34 -39.13 93.32 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.609 2.206 . . . . 0.0 113.999 173.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -35.48 79.39 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.118 -0.989 . . . . 0.0 112.648 174.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -76.7 -31.84 57.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.995 0.918 . . . . 0.0 112.08 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 95.2 m -60.13 -43.87 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.979 -1.076 . . . . 0.0 112.145 168.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.58 -19.47 45.52 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 177.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.62 -48.03 77.24 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 121.167 -0.958 . . . . 0.0 111.546 165.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -75.08 -55.55 5.62 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.504 1.122 . . . . 0.0 113.609 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.85 146.41 25.98 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.013 0.925 . . . . 0.0 112.434 -164.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmt-85 -106.41 124.81 50.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.697 1.199 . . . . 0.0 111.795 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.15 -157.61 15.46 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.765 1.174 . . . . 0.0 114.548 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -105.48 -53.41 2.66 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.568 1.547 . . . . 0.0 110.779 -178.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.0 t -63.31 -37.28 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.538 0.735 . . . . 0.0 111.498 -177.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.3 p -69.74 -45.32 68.4 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.363 1.065 . . . . 0.0 112.822 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.47 -49.64 76.77 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.536 1.135 . . . . 0.0 110.857 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -61.16 -28.09 68.87 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.061 1.344 . . . . 0.0 113.758 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -66.78 -40.67 88.27 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.92 -1.113 . . . . 0.0 110.918 172.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.0 t -67.22 -28.38 68.02 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.426 -0.796 . . . . 0.0 112.211 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.58 -16.67 63.93 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.264 1.209 . . . . 0.0 114.264 175.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.35 -49.42 2.96 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.873 1.269 . . . . 0.0 113.874 173.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -101.03 -6.45 24.4 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.542 1.537 . . . . 0.0 113.816 -169.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 61.7 m 58.87 23.39 11.3 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.9 mtm105 -128.84 163.81 24.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.146 2.178 . . . . 0.0 110.431 170.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.3 m -71.91 153.32 41.93 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.762 -0.586 . . . . 0.0 109.927 157.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.3 tt -66.77 93.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.492 1.117 . . . . 0.0 113.096 -169.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.2 mtm180 . . . . . 0 C--O 1.254 1.293 0 C-N-CA 125.835 1.654 . . . . 0.0 110.325 173.469 . . . . . . . . 0 0 . 1 stop_ save_