data_5t6t_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 5t6t _Structure_validation_residue.Date_analyzed 2017-09-01 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.513 2.705 0 CA-C-O 119.023 -0.513 . . . . 25.0 110.061 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.454 ' HG1' ' C ' ' A' ' 6' ' ' TYR . 9.4 t -139.9 148.76 42.49 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.499 -1.667 . . . . 25.0 106.499 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.5 m -144.33 -32.3 0.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 O-C-N 124.743 1.277 . . . . 50.0 111.832 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.4 m -118.88 123.45 44.72 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.05 -1.031 . . . . 50.0 111.346 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.453 ' HA3' HH21 ' A' ' 7' ' ' ARG . . . 61.23 22.62 61.07 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-O 120.117 -0.268 . . . . 50.0 113.612 178.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.454 ' C ' ' HG1' ' A' ' 2' ' ' THR . 33.0 m-85 58.38 2.69 0.22 Allowed 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 116.467 2.025 . . . . 25.0 116.467 -177.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.453 HH21 ' HA3' ' A' ' 5' ' ' GLY . 0.1 OUTLIER -119.39 -6.96 10.27 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.091 1.885 . . . . 75.0 116.091 -177.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -156.98 167.98 28.85 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 117.28 -1.343 . . . . 25.0 109.906 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.6 t -127.15 -55.8 1.35 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 120.169 1.35 . . . . 50.0 110.659 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.1 p -145.94 136.28 12.09 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-O 118.041 -0.98 . . . . 50.0 109.338 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -65.11 153.08 77.16 Favored 'Cis proline' 0 C--N 1.367 1.513 0 C-N-CA 130.965 1.652 . . . . 75.0 113.019 -5.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.9 t . . . . . 0 C--O 1.211 -0.964 0 O-C-N 124.787 1.304 . . . . 50.0 109.454 178.82 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.17 -0.919 . . . . 25.0 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -131.23 146.87 52.49 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.652 0.66 . . . . 25.0 109.45 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.9 p -153.21 -3.71 0.21 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 123.943 1.83 . . . . 50.0 113.642 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.6 t -125.56 75.54 1.49 Allowed 'General case' 0 C--O 1.255 1.393 0 N-CA-C 104.412 -2.44 . . . . 50.0 104.412 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.78 -172.37 51.79 Favored Glycine 0 C--O 1.272 2.513 0 N-CA-C 103.908 -3.677 . . . . 50.0 103.908 -173.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.95 14.78 22.44 Favored 'General case' 0 C--O 1.195 -1.781 0 C-N-CA 120.388 -0.525 . . . . 25.0 111.263 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.76 -24.15 8.84 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.194 1.553 . . . . 75.0 115.194 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -154.48 -177.9 6.79 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.318 1.011 . . . . 25.0 109.335 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.6 t -134.8 -136.57 0.16 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.227 -1.027 . . . . 50.0 108.227 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.2 m -61.15 154.52 61.27 Favored Pre-proline 0 CA--C 1.543 0.694 0 N-CA-C 109.405 -0.591 . . . . 50.0 109.405 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.53 -13.82 17.57 Favored 'Cis proline' 0 C--N 1.364 1.385 0 C-N-CA 131.608 1.92 . . . . 75.0 114.685 1.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.478 0.953 0 O-C-N 124.383 1.052 . . . . 50.0 112.309 -175.591 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.21 -1.005 0 CA-C-O 117.886 -1.054 . . . . 25.0 111.039 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.1 p -105.61 161.16 14.61 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 107.659 -1.237 . . . . 25.0 107.659 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.1 m -135.06 -30.95 1.02 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 113.79 1.033 . . . . 50.0 113.79 -173.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 23.9 p -148.63 158.6 44.25 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.373 -0.829 . . . . 50.0 110.85 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.44 23.62 62.76 Favored Glycine 0 C--O 1.225 -0.41 0 C-N-CA 120.047 -1.073 . . . . 50.0 113.787 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.2 p90 53.76 -21.02 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 118.253 2.686 . . . . 25.0 118.253 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.08 17.38 5.59 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.879 1.437 . . . . 75.0 114.879 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.0 tpp -143.64 154.42 43.52 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.565 -0.709 . . . . 25.0 110.661 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.9 t -130.98 -47.59 1.02 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-O 118.371 -0.823 . . . . 50.0 110.116 170.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.4 125.12 18.54 Favored Pre-proline 0 CA--C 1.563 1.464 0 O-C-N 124.199 0.937 . . . . 50.0 110.642 -178.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.68 168.6 76.69 Favored 'Cis proline' 0 C--N 1.368 1.589 0 C-N-CA 129.384 0.993 . . . . 75.0 110.718 -4.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 C--N 1.328 -0.366 0 N-CA-C 108.421 -0.955 . . . . 50.0 108.421 -177.767 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.496 1.846 0 CA-C-O 118.702 -0.666 . . . . 25.0 109.658 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -137.51 156.7 47.83 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.428 1.013 . . . . 25.0 111.197 -173.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.7 p -158.1 -21.72 0.08 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.286 1.587 . . . . 50.0 115.286 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 69.4 m -112.92 35.02 4.08 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 108.767 -0.827 . . . . 50.0 108.767 -175.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.31 -172.4 23.84 Favored Glycine 0 C--N 1.315 -0.62 0 N-CA-C 109.154 -1.578 . . . . 50.0 109.154 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -65.15 -30.74 71.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.302 1.223 . . . . 25.0 114.302 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.95 -7.53 3.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 117.182 2.289 . . . . 75.0 117.182 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.3 ptp -119.54 156.45 30.28 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.883 -1.136 . . . . 25.0 112.481 -172.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 t -157.81 90.83 1.09 Allowed 'General case' 0 C--O 1.211 -0.93 0 C-N-CA 124.156 0.982 . . . . 50.0 110.829 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 62.77 102.86 0.03 OUTLIER Pre-proline 0 C--O 1.208 -1.09 0 C-N-CA 125.027 1.331 . . . . 50.0 113.129 -175.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.36 155.72 43.21 Favored 'Cis proline' 0 C--N 1.356 0.945 0 N-CA-C 115.681 1.377 . . . . 50.0 115.681 -0.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 C--N 1.312 -1.047 0 N-CA-C 109.029 -0.73 . . . . 50.0 109.029 -179.68 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.214 -0.812 0 CA-C-O 119.213 -0.423 . . . . 25.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.7 t -146.49 155.33 42.45 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.593 1.088 . . . . 25.0 110.954 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' H ' ' H ' ' A' ' 4' ' ' CYS . 20.1 p -142.58 -6.23 0.91 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 107.942 -1.133 . . . . 50.0 107.942 169.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.405 ' H ' ' H ' ' A' ' 3' ' ' CYS . 45.0 m -134.25 106.56 7.2 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 105.891 -1.892 . . . . 50.0 105.891 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.57 -152.62 41.39 Favored Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 107.524 -2.23 . . . . 50.0 107.524 -177.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -113.93 19.69 16.35 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 117.781 0.79 . . . . 25.0 112.881 -175.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.72 -3.71 0.1 Allowed 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 117.037 2.236 . . . . 75.0 117.037 -175.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 ttm -133.01 152.18 51.99 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.741 0.645 . . . . 25.0 112.741 -171.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.4 t -154.77 136.1 14.08 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.361 -1.348 . . . . 50.0 107.361 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.4 t 24.94 104.45 0.01 OUTLIER Pre-proline 0 CA--C 1.562 1.435 0 N-CA-C 119.541 3.163 . . . . 50.0 119.541 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.48 156.05 89.76 Favored 'Cis proline' 0 C--N 1.36 1.164 0 C-N-CA 133.431 2.68 . . . . 50.0 114.238 3.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 104.767 -2.308 . . . . 50.0 104.767 177.883 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 118.442 -0.789 . . . . 25.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -72.46 128.83 36.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.431 -0.951 . . . . 25.0 108.431 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.2 t -158.9 -175.28 5.2 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 105.49 -2.041 . . . . 50.0 105.49 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -50.26 141.42 11.57 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 122.03 0.919 . . . . 50.0 112.002 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.76 38.94 96.77 Favored Glycine 0 C--O 1.197 -2.16 0 C-N-CA 120.074 -1.06 . . . . 75.0 111.085 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 60.92 -51.46 0.1 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 127.75 2.42 . . . . 25.0 116.062 -177.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.91 -13.22 1.24 Allowed 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 117.611 -1.185 . . . . 75.0 113.443 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.9 ptp -73.5 -30.21 62.98 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.335 1.425 . . . . 25.0 113.812 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 t 63.16 -60.16 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 N-CA-C 117.33 2.345 . . . . 50.0 117.33 174.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.35 129.93 9.67 Favored Pre-proline 0 C--O 1.205 -1.261 0 CA-C-N 119.758 1.163 . . . . 50.0 110.233 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -69.88 151.83 92.09 Favored 'Cis proline' 0 C--N 1.355 0.892 0 C-N-CA 129.822 1.176 . . . . 50.0 113.856 -4.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t . . . . . 0 C--O 1.217 -0.638 0 C-N-CA 125.042 1.337 . . . . 50.0 110.808 -178.7 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.782 0.325 . . . . 25.0 110.52 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.7 p -80.43 157.54 26.21 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.048 -0.523 . . . . 25.0 112.065 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -138.62 -15.89 1.18 Allowed 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.792 0.664 . . . . 50.0 112.792 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.9 t -136.61 112.34 9.46 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 105.559 -2.015 . . . . 50.0 105.559 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.99 -150.63 47.92 Favored Glycine 0 C--O 1.187 -2.806 0 N-CA-C 104.708 -3.357 . . . . 50.0 104.708 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -122.59 21.91 10.0 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.517 -0.873 . . . . 25.0 110.132 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 2.23 3.44 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.082 1.882 . . . . 75.0 116.082 -178.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.3 ptm -158.94 161.58 36.76 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 113.543 0.942 . . . . 25.0 113.543 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.4 t -147.41 99.75 3.17 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 107.507 -1.294 . . . . 50.0 107.507 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.446 ' H ' ' HA ' ' A' ' 11' ' ' PRO . 57.7 t -121.02 -50.89 0.04 OUTLIER Pre-proline 0 C--N 1.318 -0.803 0 O-C-N 123.508 0.505 . . . . 50.0 111.833 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.446 ' HA ' ' H ' ' A' ' 10' ' ' VAL . 26.5 Cg_endo -88.14 171.83 32.51 Favored 'Cis proline' 0 CA--C 1.565 2.057 1 C-N-CA 138.464 4.777 . . . . 50.0 111.533 -2.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.2 m . . . . . 0 C--O 1.19 -2.075 0 C-N-CA 123.752 0.821 . . . . 50.0 110.638 -179.83 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.805 -0.443 . . . . 25.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.3 p -129.57 169.14 15.39 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.34 -1.356 . . . . 25.0 107.34 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -147.45 10.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.743 1.016 . . . . 50.0 113.743 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.6 t -146.36 62.05 1.22 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 104.742 -2.318 . . . . 50.0 104.742 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.04 171.07 47.33 Favored Glycine 0 C--O 1.204 -1.726 0 CA-C-N 114.454 -1.248 . . . . 50.0 112.766 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -57.25 -26.66 61.13 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 117.622 0.711 . . . . 25.0 112.541 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 -6.9 20.47 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 118.003 2.594 . . . . 75.0 118.003 -173.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.17 168.84 21.4 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 113.568 0.951 . . . . 25.0 113.568 -171.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.94 150.44 36.99 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 104.828 -2.286 . . . . 50.0 104.828 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.73 141.11 97.16 Favored Pre-proline 0 C--O 1.218 -0.584 0 N-CA-C 108.707 -0.849 . . . . 50.0 108.707 -173.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -66.09 126.48 6.89 Favored 'Cis proline' 0 C--O 1.202 -1.299 0 C-N-CA 132.736 2.39 . . . . 75.0 110.756 -2.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 C--O 1.217 -0.624 0 CA-C-N 113.286 -1.779 . . . . 50.0 110.895 -178.485 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.965 -0.383 . . . . 25.0 109.965 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.59 143.64 44.22 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 103.763 -2.68 . . . . 25.0 103.763 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.4 p -142.13 -7.98 0.91 Allowed 'General case' 0 C--O 1.246 0.897 0 O-C-N 125.283 1.614 . . . . 50.0 114.367 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.0 m -122.78 86.07 2.52 Favored 'General case' 0 C--O 1.211 -0.929 0 N-CA-C 105.019 -2.215 . . . . 50.0 105.019 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.71 -164.42 53.1 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 106.986 -2.446 . . . . 50.0 106.986 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -102.02 25.73 8.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.009 -0.7 . . . . 25.0 109.12 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.86 -8.8 1.84 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 116.333 1.975 . . . . 75.0 116.333 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.3 ttp -150.36 166.91 28.61 Favored 'General case' 0 C--O 1.272 2.238 0 C-N-CA 119.271 -0.972 . . . . 25.0 109.125 -175.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.2 t -163.42 -42.42 0.03 OUTLIER 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.525 -0.47 . . . . 50.0 111.501 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.0 t -128.64 120.84 20.87 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-O 117.485 -1.245 . . . . 50.0 110.981 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -84.98 166.13 57.53 Favored 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 129.899 1.208 . . . . 50.0 111.323 -10.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 105.011 -2.218 . . . . 50.0 105.011 173.661 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 119.084 -0.484 . . . . 25.0 109.847 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 6' ' ' TYR . 9.0 t -139.65 143.51 37.2 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 104.707 -2.331 . . . . 25.0 104.707 177.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.7 p -163.94 -34.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.116 1.51 . . . . 50.0 114.6 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.3 p -95.3 -14.85 23.59 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 113.385 0.883 . . . . 50.0 113.385 -175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.38 61.36 0.1 Allowed Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 118.878 2.311 . . . . 50.0 118.878 -175.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.425 ' C ' ' HG1' ' A' ' 2' ' ' THR . 83.1 t80 62.97 -47.88 0.2 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 116.691 2.108 . . . . 25.0 116.691 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 7.57 9.49 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.102 1.149 . . . . 75.0 114.102 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.0 mtt -143.98 156.95 44.6 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.653 0.612 . . . . 25.0 112.653 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.0 t -142.77 -178.93 6.04 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 102.323 -3.214 . . . . 50.0 102.323 176.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.18 131.36 60.37 Favored Pre-proline 0 CA--C 1.573 1.849 0 CA-C-N 119.491 1.041 . . . . 50.0 112.238 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -67.34 132.11 17.54 Favored 'Cis proline' 0 C--N 1.381 2.264 0 C-N-CA 131.19 1.746 . . . . 75.0 114.502 -0.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 N--CA 1.488 1.467 0 O-C-N 120.766 -1.209 . . . . 50.0 110.516 -176.179 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.096 -0.705 . . . . 25.0 109.096 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.2 t -145.21 146.15 31.61 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.188 -1.412 . . . . 25.0 107.188 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.0 p -154.67 -6.24 0.14 Allowed 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.055 -0.975 . . . . 50.0 109.557 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 25.3 p -152.18 155.25 37.43 Favored 'General case' 0 C--O 1.293 3.37 0 CA-C-O 118.575 -0.726 . . . . 50.0 110.682 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.52 21.06 40.56 Favored Glycine 0 CA--C 1.546 1.972 0 C-N-CA 119.464 -1.351 . . . . 50.0 114.929 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.7 t80 65.21 -19.97 0.08 Allowed 'General case' 0 C--O 1.201 -1.457 0 N-CA-C 116.363 1.986 . . . . 25.0 116.363 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.12 25.01 0.91 Allowed 'General case' 0 CA--C 1.56 1.328 0 O-C-N 121.118 -0.989 . . . . 75.0 113.275 -175.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.2 tpp -135.67 154.13 51.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.005 -1.06 . . . . 25.0 109.806 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.7 t -162.8 149.88 13.16 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 114.131 1.16 . . . . 50.0 114.131 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 m 28.31 85.36 0.13 Allowed Pre-proline 0 N--CA 1.483 1.208 0 N-CA-C 118.357 2.725 . . . . 50.0 118.357 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -87.02 173.84 31.46 Favored 'Cis proline' 0 CA--C 1.486 -1.881 0 C-N-CA 131.376 1.823 . . . . 50.0 111.746 0.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m . . . . . 0 CA--C 1.556 1.183 0 N-CA-C 107.502 -1.296 . . . . 50.0 107.502 175.885 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.495 1.783 0 N-CA-C 109.261 -0.644 . . . . 25.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.8 t -155.24 141.18 18.24 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 117.405 -1.283 . . . . 25.0 108.727 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 p -129.98 -4.65 4.52 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 124.905 1.378 . . . . 50.0 109.079 176.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.6 t -133.05 100.87 5.01 Favored 'General case' 0 C--O 1.263 1.782 0 N-CA-C 107.065 -1.457 . . . . 50.0 107.065 -178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.24 -153.48 49.58 Favored Glycine 0 C--O 1.21 -1.367 0 C-N-CA 119.529 -1.319 . . . . 50.0 111.656 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -100.61 0.79 39.92 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.298 0.481 . . . . 25.0 112.298 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.52 -10.66 4.04 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.954 2.946 . . . . 75.0 118.954 -175.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.6 mtp -144.2 -179.56 6.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 120.229 1.377 . . . . 25.0 114.239 -169.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -152.41 -179.4 7.53 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 102.043 -3.317 . . . . 50.0 102.043 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 t -60.4 132.77 90.78 Favored Pre-proline 0 CA--C 1.56 1.328 0 CA-C-O 117.859 -1.067 . . . . 50.0 111.339 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.71 132.16 23.92 Favored 'Cis proline' 0 C--O 1.21 -0.897 0 C-N-CA 130.453 1.439 . . . . 75.0 113.297 6.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.467 0.424 0 CA-C-N 114.29 -1.323 . . . . 50.0 111.293 -178.886 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.531 -0.915 . . . . 25.0 108.531 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -138.24 144.74 40.72 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 123.342 1.544 . . . . 25.0 109.919 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 p -159.09 -6.85 0.07 Allowed 'General case' 0 CA--C 1.576 1.957 0 CA-C-N 113.051 -1.886 . . . . 50.0 110.186 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.1 t -122.74 95.34 4.59 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 102.574 -3.121 . . . . 50.0 102.574 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.92 -159.8 53.87 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 107.197 -2.361 . . . . 50.0 107.197 -169.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -114.62 28.43 8.73 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 122.134 -0.627 . . . . 25.0 112.112 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.31 -27.85 2.64 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 114.929 1.455 . . . . 75.0 114.929 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ptp -154.58 176.07 12.85 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.334 -1.479 . . . . 25.0 111.984 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.3 t -126.46 -176.43 3.67 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 108.875 -0.787 . . . . 50.0 108.875 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.6 t -61.35 134.16 93.27 Favored Pre-proline 0 N--CA 1.482 1.153 0 N-CA-C 108.439 -0.949 . . . . 50.0 108.439 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.47 120.33 7.14 Favored 'Cis proline' 0 C--N 1.353 0.767 0 C-N-CA 131.92 2.05 . . . . 75.0 112.049 2.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 C--O 1.214 -0.783 0 CA-C-O 122.576 1.179 . . . . 50.0 112.377 -173.871 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 118.365 -0.826 . . . . 25.0 110.084 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.6 m -81.37 136.19 35.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.263 0.938 . . . . 25.0 108.52 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.51 -142.86 0.13 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 118.637 -0.697 . . . . 50.0 110.544 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.3 m -66.92 137.37 56.5 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.067 0.461 . . . . 50.0 110.003 -177.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.6 22.57 46.6 Favored Glycine 0 N--CA 1.478 1.495 0 N-CA-C 110.105 -1.198 . . . . 50.0 110.105 -176.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 60.45 12.29 3.42 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.16 1.784 . . . . 25.0 113.246 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -140.36 -65.27 0.46 Allowed 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 114.804 1.409 . . . . 75.0 114.804 -177.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.8 ttp -82.63 143.26 31.1 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.255 -0.646 . . . . 25.0 109.255 -171.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.36 -14.58 6.4 Favored 'General case' 0 C--O 1.206 -1.207 0 C-N-CA 120.005 -0.678 . . . . 50.0 112.513 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -134.29 124.15 17.07 Favored Pre-proline 0 C--N 1.321 -0.661 0 O-C-N 121.817 -0.552 . . . . 50.0 110.693 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -94.86 8.67 49.53 Favored 'Cis proline' 0 C--O 1.254 1.276 0 C-N-CA 133.647 2.77 . . . . 50.0 113.558 -2.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.9 m . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 123.165 1.459 . . . . 50.0 111.351 -176.862 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.192 -1.971 0 CA-C-O 121.07 0.462 . . . . 25.0 110.356 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.7 m -112.91 118.16 34.11 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.663 -0.866 . . . . 25.0 108.663 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 30.5 m -134.6 -54.9 0.84 Allowed 'General case' 0 C--O 1.193 -1.9 0 CA-C-O 122.172 0.987 . . . . 50.0 110.964 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.4 m -126.34 122.7 36.16 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-O 122.154 0.978 . . . . 50.0 111.219 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 50.33 34.4 25.84 Favored Glycine 0 N--CA 1.476 1.305 0 O-C-N 119.775 -1.828 . . . . 50.0 116.092 -178.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.5 t80 66.83 -53.4 0.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.092 1.516 . . . . 25.0 115.092 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -84.13 -19.03 34.88 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.91 2.559 . . . . 75.0 117.91 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 54.4 ttm -114.62 150.18 35.48 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.408 1.004 . . . . 25.0 109.67 -172.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 19.3 t -148.5 -48.9 0.16 Allowed 'General case' 0 C--O 1.248 0.991 0 CA-C-O 117.631 -1.176 . . . . 50.0 113.279 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -136.74 114.11 10.13 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 113.646 0.98 . . . . 50.0 113.646 177.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -65.1 151.71 76.47 Favored 'Cis proline' 0 C--N 1.374 1.913 0 C-N-CA 129.722 1.134 . . . . 50.0 112.813 -5.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.5 t . . . . . 0 C--N 1.302 -1.49 0 N-CA-C 108.238 -1.023 . . . . 50.0 108.238 179.396 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 C--O 1.184 -2.385 0 CA-C-O 120.901 0.381 . . . . 25.0 110.298 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.9 p -131.18 179.14 6.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 106.673 -1.603 . . . . 25.0 106.673 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.08 -49.01 0.42 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.684 1.735 . . . . 50.0 115.684 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.35 -44.49 75.14 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 119.293 0.951 . . . . 50.0 113.318 -171.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.52 42.43 0.68 Allowed Glycine 0 C--N 1.31 -0.913 0 N-CA-C 115.387 0.915 . . . . 50.0 115.387 -176.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 61.14 -13.67 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 117.662 2.467 . . . . 25.0 117.662 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -131.7 12.5 4.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.712 0.768 . . . . 75.0 111.575 176.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.8 ttm -152.49 142.45 22.16 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 115.359 -0.837 . . . . 25.0 112.409 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.1 t -164.27 145.13 8.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 50.0 107.569 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 t 35.96 90.47 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 N-CA-C 117.966 2.58 . . . . 50.0 117.966 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -83.19 178.31 28.84 Favored 'Cis proline' 0 CA--C 1.498 -1.297 0 C-N-CA 132.302 2.209 . . . . 50.0 108.755 -4.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.436 -1.144 0 N-CA-C 104.568 -2.382 . . . . 50.0 104.568 176.693 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.3 t . . . . . 0 N--CA 1.501 2.081 0 N-CA-C 109.445 -0.576 . . . . 25.0 109.445 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 97.7 m -83.42 117.69 23.22 Favored 'General case' 0 C--O 1.2 -1.501 0 O-C-N 121.375 -0.828 . . . . 25.0 110.23 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.9 m -138.97 -46.31 0.48 Allowed 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 113.246 0.832 . . . . 50.0 113.246 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.81 -60.84 1.76 Allowed 'General case' 0 C--O 1.188 -2.173 0 CA-C-O 122.056 0.931 . . . . 50.0 111.46 -173.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.16 35.41 5.0 Favored Glycine 0 N--CA 1.473 1.154 0 O-C-N 121.03 -1.044 . . . . 50.0 111.234 -170.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.8 t80 62.43 -64.49 0.09 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.668 1.587 . . . . 25.0 114.028 -177.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -87.04 14.72 6.99 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.706 -1.246 . . . . 75.0 112.017 -178.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 49.2 tpp -154.73 152.16 29.57 Favored 'General case' 0 C--O 1.283 2.831 0 O-C-N 121.617 -0.677 . . . . 25.0 111.052 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 t -106.3 -53.81 2.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 114.19 1.182 . . . . 50.0 114.19 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -144.33 160.68 47.74 Favored Pre-proline 0 C--O 1.215 -0.753 0 N-CA-C 105.257 -2.127 . . . . 50.0 105.257 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.64 150.9 96.33 Favored 'Cis proline' 0 C--N 1.372 1.805 0 O-C-N 123.147 1.077 . . . . 75.0 111.075 -5.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.215 -0.712 0 O-C-N 124.415 1.072 . . . . 50.0 111.187 -179.198 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.508 2.451 0 CA-C-O 118.329 -0.843 . . . . 25.0 110.025 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.7 p -73.03 159.82 33.04 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 106.692 -1.596 . . . . 25.0 106.692 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.498 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -137.93 -19.31 1.16 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.088 1.514 . . . . 50.0 115.088 -179.212 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.7 t -147.32 149.84 33.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.035 -0.728 . . . . 50.0 109.035 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.11 -149.23 31.34 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.268 0.94 . . . . 50.0 111.674 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -75.54 -39.74 57.88 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 123.075 1.417 . . . . 25.0 112.573 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.27 15.11 1.14 Allowed 'General case' 0 C--O 1.211 -0.967 0 N-CA-C 116.312 1.968 . . . . 75.0 116.312 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.3 mmt -81.77 -176.87 6.31 Favored 'General case' 0 C--O 1.242 0.686 0 O-C-N 120.592 -1.318 . . . . 25.0 107.82 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.498 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 15.9 t -150.62 179.65 8.0 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 104.006 -2.59 . . . . 50.0 104.006 175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.0 m -68.45 145.65 97.37 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 119.046 0.839 . . . . 50.0 112.416 -173.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -66.21 143.32 61.85 Favored 'Cis proline' 0 CA--C 1.536 0.614 0 C-N-CA 131.759 1.983 . . . . 75.0 110.793 2.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 107.393 -1.336 . . . . 50.0 107.393 -173.392 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.608 -0.516 . . . . 25.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -81.55 157.5 24.77 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 107.878 -1.156 . . . . 25.0 107.878 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 8' ' ' MET . 9.3 t -158.03 -154.95 0.47 Allowed 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 106.428 -1.693 . . . . 50.0 106.428 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.68 150.86 39.86 Favored 'General case' 0 C--O 1.261 1.666 0 N-CA-C 107.85 -1.167 . . . . 50.0 107.85 173.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 66.49 -145.49 47.31 Favored Glycine 0 C--O 1.211 -1.301 0 N-CA-C 105.035 -3.226 . . . . 50.0 105.035 -172.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -79.18 -44.96 20.87 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 106.531 -1.655 . . . . 25.0 106.531 164.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.15 134.5 14.27 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 103.742 -2.688 . . . . 75.0 103.742 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.485 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 17.4 ttt -166.05 44.51 0.07 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 105.389 -2.078 . . . . 25.0 105.389 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -88.16 73.92 8.89 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 122.555 1.169 . . . . 50.0 112.191 -175.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -77.86 -11.06 0.17 Allowed Pre-proline 0 CA--C 1.581 2.166 0 N-CA-C 119.451 3.13 . . . . 50.0 119.451 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.37 150.04 87.36 Favored 'Cis proline' 0 N--CA 1.488 1.198 1 C-N-CA 137.469 4.362 . . . . 50.0 115.649 2.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.473 0.71 0 C-N-CA 120.333 -0.547 . . . . 50.0 110.237 177.667 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.19 -2.075 0 N-CA-C 109.225 -0.657 . . . . 25.0 109.225 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.8 p -71.88 146.24 48.02 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.791 0.723 . . . . 25.0 110.081 -175.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 14.1 m -126.83 -130.04 0.23 Allowed 'General case' 0 CA--C 1.565 1.552 0 O-C-N 123.869 0.731 . . . . 50.0 110.777 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.9 p -58.97 123.49 16.74 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 116.011 1.856 . . . . 50.0 116.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.64 12.95 74.46 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 120.932 -1.105 . . . . 50.0 115.182 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 64.1 142.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.74 1.216 . . . . 25.0 113.518 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.32 -44.87 0.07 Allowed 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 127.912 2.485 . . . . 75.0 115.888 -174.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 60.3 ttp -68.27 152.24 45.74 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.81 1.644 . . . . 25.0 108.578 175.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.406 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 10.7 t -156.14 -51.9 0.08 Allowed 'General case' 0 C--O 1.207 -1.169 0 N-CA-C 113.883 1.068 . . . . 50.0 113.883 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.3 t -139.33 111.95 7.85 Favored Pre-proline 0 N--CA 1.484 1.243 0 CA-C-O 116.853 -1.546 . . . . 50.0 108.96 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.91 163.7 90.04 Favored 'Cis proline' 0 CA--C 1.553 1.436 0 O-C-N 124.744 1.918 . . . . 50.0 115.091 -5.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.5 m . . . . . 0 C--O 1.211 -0.957 0 N-CA-C 106.611 -1.625 . . . . 50.0 106.611 172.434 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.513 2.705 0 CA-C-O 119.023 -0.513 . . . . 25.0 110.061 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.454 ' HG1' ' C ' ' A' ' 6' ' ' TYR . 9.4 t -139.9 148.76 42.49 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.499 -1.667 . . . . 25.0 106.499 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.5 m -144.33 -32.3 0.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 O-C-N 124.743 1.277 . . . . 50.0 111.832 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.4 m -118.88 123.45 44.72 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.05 -1.031 . . . . 50.0 111.346 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.453 ' HA3' HH21 ' A' ' 7' ' ' ARG . . . 61.23 22.62 61.07 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-O 120.117 -0.268 . . . . 50.0 113.612 178.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.454 ' C ' ' HG1' ' A' ' 2' ' ' THR . 33.0 m-85 58.38 2.69 0.22 Allowed 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 116.467 2.025 . . . . 25.0 116.467 -177.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.453 HH21 ' HA3' ' A' ' 5' ' ' GLY . 0.1 OUTLIER -119.39 -6.96 10.27 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.091 1.885 . . . . 75.0 116.091 -177.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -156.98 167.98 28.85 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 117.28 -1.343 . . . . 25.0 109.906 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.6 t -127.15 -55.8 1.35 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 120.169 1.35 . . . . 50.0 110.659 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.1 p -145.94 136.28 12.09 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-O 118.041 -0.98 . . . . 50.0 109.338 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -65.11 153.08 77.16 Favored 'Cis proline' 0 C--N 1.367 1.513 0 C-N-CA 130.965 1.652 . . . . 75.0 113.019 -5.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.9 t -143.01 130.11 20.75 Favored 'General case' 0 C--O 1.211 -0.964 0 O-C-N 124.787 1.304 . . . . 50.0 109.454 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.679 0 O-C-N 121.226 -0.921 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.17 -0.919 . . . . 25.0 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -131.23 146.87 52.49 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.652 0.66 . . . . 25.0 109.45 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.9 p -153.21 -3.71 0.21 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 123.943 1.83 . . . . 50.0 113.642 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.6 t -125.56 75.54 1.49 Allowed 'General case' 0 C--O 1.255 1.393 0 N-CA-C 104.412 -2.44 . . . . 50.0 104.412 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.78 -172.37 51.79 Favored Glycine 0 C--O 1.272 2.513 0 N-CA-C 103.908 -3.677 . . . . 50.0 103.908 -173.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.95 14.78 22.44 Favored 'General case' 0 C--O 1.195 -1.781 0 C-N-CA 120.388 -0.525 . . . . 25.0 111.263 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.76 -24.15 8.84 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.194 1.553 . . . . 75.0 115.194 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -154.48 -177.9 6.79 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.318 1.011 . . . . 25.0 109.335 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.6 t -134.8 -136.57 0.16 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.227 -1.027 . . . . 50.0 108.227 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.2 m -61.15 154.52 61.27 Favored Pre-proline 0 CA--C 1.543 0.694 0 N-CA-C 109.405 -0.591 . . . . 50.0 109.405 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.53 -13.82 17.57 Favored 'Cis proline' 0 C--N 1.364 1.385 0 C-N-CA 131.608 1.92 . . . . 75.0 114.685 1.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.1 t 53.5 56.51 7.22 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 124.383 1.052 . . . . 50.0 112.309 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.05 0 O-C-N 119.392 -2.067 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.21 -1.005 0 CA-C-O 117.886 -1.054 . . . . 25.0 111.039 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.1 p -105.61 161.16 14.61 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 107.659 -1.237 . . . . 25.0 107.659 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.1 m -135.06 -30.95 1.02 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 113.79 1.033 . . . . 50.0 113.79 -173.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 23.9 p -148.63 158.6 44.25 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.373 -0.829 . . . . 50.0 110.85 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.44 23.62 62.76 Favored Glycine 0 C--O 1.225 -0.41 0 C-N-CA 120.047 -1.073 . . . . 50.0 113.787 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.2 p90 53.76 -21.02 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 118.253 2.686 . . . . 25.0 118.253 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.08 17.38 5.59 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.879 1.437 . . . . 75.0 114.879 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.0 tpp -143.64 154.42 43.52 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.565 -0.709 . . . . 25.0 110.661 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.9 t -130.98 -47.59 1.02 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-O 118.371 -0.823 . . . . 50.0 110.116 170.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.4 125.12 18.54 Favored Pre-proline 0 CA--C 1.563 1.464 0 O-C-N 124.199 0.937 . . . . 50.0 110.642 -178.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.68 168.6 76.69 Favored 'Cis proline' 0 C--N 1.368 1.589 0 C-N-CA 129.384 0.993 . . . . 75.0 110.718 -4.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.9 t -136.86 127.87 27.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.421 -0.955 . . . . 50.0 108.421 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.595 0 O-C-N 121.144 -0.972 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.496 1.846 0 CA-C-O 118.702 -0.666 . . . . 25.0 109.658 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -137.51 156.7 47.83 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.428 1.013 . . . . 25.0 111.197 -173.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.7 p -158.1 -21.72 0.08 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.286 1.587 . . . . 50.0 115.286 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 69.4 m -112.92 35.02 4.08 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 108.767 -0.827 . . . . 50.0 108.767 -175.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.31 -172.4 23.84 Favored Glycine 0 C--N 1.315 -0.62 0 N-CA-C 109.154 -1.578 . . . . 50.0 109.154 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -65.15 -30.74 71.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.302 1.223 . . . . 25.0 114.302 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.95 -7.53 3.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 117.182 2.289 . . . . 75.0 117.182 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.3 ptp -119.54 156.45 30.28 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.883 -1.136 . . . . 25.0 112.481 -172.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 t -157.81 90.83 1.09 Allowed 'General case' 0 C--O 1.211 -0.93 0 C-N-CA 124.156 0.982 . . . . 50.0 110.829 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 62.77 102.86 0.03 OUTLIER Pre-proline 0 C--O 1.208 -1.09 0 C-N-CA 125.027 1.331 . . . . 50.0 113.129 -175.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.36 155.72 43.21 Favored 'Cis proline' 0 C--N 1.356 0.945 0 N-CA-C 115.681 1.377 . . . . 50.0 115.681 -0.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.5 m -127.09 131.0 50.95 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.029 -0.73 . . . . 50.0 109.029 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.68 0 O-C-N 124.009 0.818 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.214 -0.812 0 CA-C-O 119.213 -0.423 . . . . 25.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.7 t -146.49 155.33 42.45 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.593 1.088 . . . . 25.0 110.954 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' H ' ' H ' ' A' ' 4' ' ' CYS . 20.1 p -142.58 -6.23 0.91 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 107.942 -1.133 . . . . 50.0 107.942 169.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.405 ' H ' ' H ' ' A' ' 3' ' ' CYS . 45.0 m -134.25 106.56 7.2 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 105.891 -1.892 . . . . 50.0 105.891 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.57 -152.62 41.39 Favored Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 107.524 -2.23 . . . . 50.0 107.524 -177.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -113.93 19.69 16.35 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 117.781 0.79 . . . . 25.0 112.881 -175.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.72 -3.71 0.1 Allowed 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 117.037 2.236 . . . . 75.0 117.037 -175.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 ttm -133.01 152.18 51.99 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.741 0.645 . . . . 25.0 112.741 -171.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.4 t -154.77 136.1 14.08 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.361 -1.348 . . . . 50.0 107.361 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.4 t 24.94 104.45 0.01 OUTLIER Pre-proline 0 CA--C 1.562 1.435 0 N-CA-C 119.541 3.163 . . . . 50.0 119.541 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.48 156.05 89.76 Favored 'Cis proline' 0 C--N 1.36 1.164 0 C-N-CA 133.431 2.68 . . . . 50.0 114.238 3.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.2 p -172.02 165.66 6.25 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 104.767 -2.308 . . . . 50.0 104.767 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.373 1.624 0 O-C-N 119.574 -1.953 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 118.442 -0.789 . . . . 25.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -72.46 128.83 36.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.431 -0.951 . . . . 25.0 108.431 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.2 t -158.9 -175.28 5.2 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 105.49 -2.041 . . . . 50.0 105.49 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -50.26 141.42 11.57 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 122.03 0.919 . . . . 50.0 112.002 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.76 38.94 96.77 Favored Glycine 0 C--O 1.197 -2.16 0 C-N-CA 120.074 -1.06 . . . . 75.0 111.085 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 60.92 -51.46 0.1 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 127.75 2.42 . . . . 25.0 116.062 -177.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.91 -13.22 1.24 Allowed 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 117.611 -1.185 . . . . 75.0 113.443 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.9 ptp -73.5 -30.21 62.98 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.335 1.425 . . . . 25.0 113.812 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 t 63.16 -60.16 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 N-CA-C 117.33 2.345 . . . . 50.0 117.33 174.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.35 129.93 9.67 Favored Pre-proline 0 C--O 1.205 -1.261 0 CA-C-N 119.758 1.163 . . . . 50.0 110.233 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -69.88 151.83 92.09 Favored 'Cis proline' 0 C--N 1.355 0.892 0 C-N-CA 129.822 1.176 . . . . 50.0 113.856 -4.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -104.17 114.67 29.07 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 125.042 1.337 . . . . 50.0 110.808 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.841 0 O-C-N 121.268 -0.895 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.782 0.325 . . . . 25.0 110.52 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.7 p -80.43 157.54 26.21 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.048 -0.523 . . . . 25.0 112.065 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -138.62 -15.89 1.18 Allowed 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.792 0.664 . . . . 50.0 112.792 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.9 t -136.61 112.34 9.46 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 105.559 -2.015 . . . . 50.0 105.559 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.99 -150.63 47.92 Favored Glycine 0 C--O 1.187 -2.806 0 N-CA-C 104.708 -3.357 . . . . 50.0 104.708 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -122.59 21.91 10.0 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.517 -0.873 . . . . 25.0 110.132 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 2.23 3.44 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.082 1.882 . . . . 75.0 116.082 -178.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.3 ptm -158.94 161.58 36.76 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 113.543 0.942 . . . . 25.0 113.543 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.4 t -147.41 99.75 3.17 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 107.507 -1.294 . . . . 50.0 107.507 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.446 ' H ' ' HA ' ' A' ' 11' ' ' PRO . 57.7 t -121.02 -50.89 0.04 OUTLIER Pre-proline 0 C--N 1.318 -0.803 0 O-C-N 123.508 0.505 . . . . 50.0 111.833 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' HA ' ' H ' ' A' ' 10' ' ' VAL . 26.5 Cg_endo -88.14 171.83 32.51 Favored 'Cis proline' 0 CA--C 1.565 2.057 1 C-N-CA 138.464 4.777 . . . . 50.0 111.533 -2.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.2 m -68.2 156.12 38.24 Favored 'General case' 0 C--O 1.19 -2.075 0 C-N-CA 123.752 0.821 . . . . 50.0 110.638 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.101 0 O-C-N 121.856 -0.527 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.805 -0.443 . . . . 25.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.3 p -129.57 169.14 15.39 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.34 -1.356 . . . . 25.0 107.34 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -147.45 10.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.743 1.016 . . . . 50.0 113.743 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.6 t -146.36 62.05 1.22 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 104.742 -2.318 . . . . 50.0 104.742 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.04 171.07 47.33 Favored Glycine 0 C--O 1.204 -1.726 0 CA-C-N 114.454 -1.248 . . . . 50.0 112.766 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -57.25 -26.66 61.13 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 117.622 0.711 . . . . 25.0 112.541 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 -6.9 20.47 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 118.003 2.594 . . . . 75.0 118.003 -173.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.17 168.84 21.4 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 113.568 0.951 . . . . 25.0 113.568 -171.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.94 150.44 36.99 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 104.828 -2.286 . . . . 50.0 104.828 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.73 141.11 97.16 Favored Pre-proline 0 C--O 1.218 -0.584 0 N-CA-C 108.707 -0.849 . . . . 50.0 108.707 -173.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -66.09 126.48 6.89 Favored 'Cis proline' 0 C--O 1.202 -1.299 0 C-N-CA 132.736 2.39 . . . . 75.0 110.756 -2.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.7 p -138.36 14.1 2.79 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 113.286 -1.779 . . . . 50.0 110.895 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 0.376 0 O-C-N 119.803 -1.811 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.965 -0.383 . . . . 25.0 109.965 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.59 143.64 44.22 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 103.763 -2.68 . . . . 25.0 103.763 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.4 p -142.13 -7.98 0.91 Allowed 'General case' 0 C--O 1.246 0.897 0 O-C-N 125.283 1.614 . . . . 50.0 114.367 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.0 m -122.78 86.07 2.52 Favored 'General case' 0 C--O 1.211 -0.929 0 N-CA-C 105.019 -2.215 . . . . 50.0 105.019 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.71 -164.42 53.1 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 106.986 -2.446 . . . . 50.0 106.986 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -102.02 25.73 8.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.009 -0.7 . . . . 25.0 109.12 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.86 -8.8 1.84 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 116.333 1.975 . . . . 75.0 116.333 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.3 ttp -150.36 166.91 28.61 Favored 'General case' 0 C--O 1.272 2.238 0 C-N-CA 119.271 -0.972 . . . . 25.0 109.125 -175.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.2 t -163.42 -42.42 0.03 OUTLIER 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.525 -0.47 . . . . 50.0 111.501 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.0 t -128.64 120.84 20.87 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-O 117.485 -1.245 . . . . 50.0 110.981 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -84.98 166.13 57.53 Favored 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 129.899 1.208 . . . . 50.0 111.323 -10.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -139.14 156.0 47.45 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 105.011 -2.218 . . . . 50.0 105.011 173.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 O-C-N 121.025 -1.047 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 119.084 -0.484 . . . . 25.0 109.847 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 6' ' ' TYR . 9.0 t -139.65 143.51 37.2 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 104.707 -2.331 . . . . 25.0 104.707 177.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.7 p -163.94 -34.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.116 1.51 . . . . 50.0 114.6 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.3 p -95.3 -14.85 23.59 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 113.385 0.883 . . . . 50.0 113.385 -175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.38 61.36 0.1 Allowed Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 118.878 2.311 . . . . 50.0 118.878 -175.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.425 ' C ' ' HG1' ' A' ' 2' ' ' THR . 83.1 t80 62.97 -47.88 0.2 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 116.691 2.108 . . . . 25.0 116.691 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 7.57 9.49 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.102 1.149 . . . . 75.0 114.102 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.0 mtt -143.98 156.95 44.6 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.653 0.612 . . . . 25.0 112.653 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.0 t -142.77 -178.93 6.04 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 102.323 -3.214 . . . . 50.0 102.323 176.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.18 131.36 60.37 Favored Pre-proline 0 CA--C 1.573 1.849 0 CA-C-N 119.491 1.041 . . . . 50.0 112.238 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -67.34 132.11 17.54 Favored 'Cis proline' 0 C--N 1.381 2.264 0 C-N-CA 131.19 1.746 . . . . 75.0 114.502 -0.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.2 t -114.63 144.41 43.45 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.766 -1.209 . . . . 50.0 110.516 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.776 0 O-C-N 121.534 -0.728 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.096 -0.705 . . . . 25.0 109.096 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.2 t -145.21 146.15 31.61 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.188 -1.412 . . . . 25.0 107.188 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.0 p -154.67 -6.24 0.14 Allowed 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.055 -0.975 . . . . 50.0 109.557 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 25.3 p -152.18 155.25 37.43 Favored 'General case' 0 C--O 1.293 3.37 0 CA-C-O 118.575 -0.726 . . . . 50.0 110.682 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.52 21.06 40.56 Favored Glycine 0 CA--C 1.546 1.972 0 C-N-CA 119.464 -1.351 . . . . 50.0 114.929 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.7 t80 65.21 -19.97 0.08 Allowed 'General case' 0 C--O 1.201 -1.457 0 N-CA-C 116.363 1.986 . . . . 25.0 116.363 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.12 25.01 0.91 Allowed 'General case' 0 CA--C 1.56 1.328 0 O-C-N 121.118 -0.989 . . . . 75.0 113.275 -175.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.2 tpp -135.67 154.13 51.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.005 -1.06 . . . . 25.0 109.806 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.7 t -162.8 149.88 13.16 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 114.131 1.16 . . . . 50.0 114.131 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 m 28.31 85.36 0.13 Allowed Pre-proline 0 N--CA 1.483 1.208 0 N-CA-C 118.357 2.725 . . . . 50.0 118.357 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -87.02 173.84 31.46 Favored 'Cis proline' 0 CA--C 1.486 -1.881 0 C-N-CA 131.376 1.823 . . . . 50.0 111.746 0.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -110.04 169.37 8.77 Favored 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 107.502 -1.296 . . . . 50.0 107.502 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.284 0 O-C-N 121.538 -0.726 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.495 1.783 0 N-CA-C 109.261 -0.644 . . . . 25.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.8 t -155.24 141.18 18.24 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 117.405 -1.283 . . . . 25.0 108.727 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 p -129.98 -4.65 4.52 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 124.905 1.378 . . . . 50.0 109.079 176.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.6 t -133.05 100.87 5.01 Favored 'General case' 0 C--O 1.263 1.782 0 N-CA-C 107.065 -1.457 . . . . 50.0 107.065 -178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.24 -153.48 49.58 Favored Glycine 0 C--O 1.21 -1.367 0 C-N-CA 119.529 -1.319 . . . . 50.0 111.656 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -100.61 0.79 39.92 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.298 0.481 . . . . 25.0 112.298 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.52 -10.66 4.04 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.954 2.946 . . . . 75.0 118.954 -175.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.6 mtp -144.2 -179.56 6.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 120.229 1.377 . . . . 25.0 114.239 -169.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -152.41 -179.4 7.53 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 102.043 -3.317 . . . . 50.0 102.043 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 t -60.4 132.77 90.78 Favored Pre-proline 0 CA--C 1.56 1.328 0 CA-C-O 117.859 -1.067 . . . . 50.0 111.339 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.71 132.16 23.92 Favored 'Cis proline' 0 C--O 1.21 -0.897 0 C-N-CA 130.453 1.439 . . . . 75.0 113.297 6.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.04 147.18 27.51 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 114.29 -1.323 . . . . 50.0 111.293 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 116.757 -0.201 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.531 -0.915 . . . . 25.0 108.531 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -138.24 144.74 40.72 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 123.342 1.544 . . . . 25.0 109.919 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 p -159.09 -6.85 0.07 Allowed 'General case' 0 CA--C 1.576 1.957 0 CA-C-N 113.051 -1.886 . . . . 50.0 110.186 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.1 t -122.74 95.34 4.59 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 102.574 -3.121 . . . . 50.0 102.574 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.92 -159.8 53.87 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 107.197 -2.361 . . . . 50.0 107.197 -169.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -114.62 28.43 8.73 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 122.134 -0.627 . . . . 25.0 112.112 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.31 -27.85 2.64 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 114.929 1.455 . . . . 75.0 114.929 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ptp -154.58 176.07 12.85 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.334 -1.479 . . . . 25.0 111.984 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.3 t -126.46 -176.43 3.67 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 108.875 -0.787 . . . . 50.0 108.875 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.6 t -61.35 134.16 93.27 Favored Pre-proline 0 N--CA 1.482 1.153 0 N-CA-C 108.439 -0.949 . . . . 50.0 108.439 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.47 120.33 7.14 Favored 'Cis proline' 0 C--N 1.353 0.767 0 C-N-CA 131.92 2.05 . . . . 75.0 112.049 2.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.5 t -95.77 128.53 42.72 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-O 122.576 1.179 . . . . 50.0 112.377 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 O-C-N 120.373 -1.454 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 118.365 -0.826 . . . . 25.0 110.084 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.6 m -81.37 136.19 35.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.263 0.938 . . . . 25.0 108.52 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.51 -142.86 0.13 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 118.637 -0.697 . . . . 50.0 110.544 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.3 m -66.92 137.37 56.5 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.067 0.461 . . . . 50.0 110.003 -177.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.6 22.57 46.6 Favored Glycine 0 N--CA 1.478 1.495 0 N-CA-C 110.105 -1.198 . . . . 50.0 110.105 -176.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 60.45 12.29 3.42 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.16 1.784 . . . . 25.0 113.246 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -140.36 -65.27 0.46 Allowed 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 114.804 1.409 . . . . 75.0 114.804 -177.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.8 ttp -82.63 143.26 31.1 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.255 -0.646 . . . . 25.0 109.255 -171.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.36 -14.58 6.4 Favored 'General case' 0 C--O 1.206 -1.207 0 C-N-CA 120.005 -0.678 . . . . 50.0 112.513 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -134.29 124.15 17.07 Favored Pre-proline 0 C--N 1.321 -0.661 0 O-C-N 121.817 -0.552 . . . . 50.0 110.693 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -94.86 8.67 49.53 Favored 'Cis proline' 0 C--O 1.254 1.276 0 C-N-CA 133.647 2.77 . . . . 50.0 113.558 -2.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.9 m 53.69 53.56 11.25 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 123.165 1.459 . . . . 50.0 111.351 -176.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.512 0 CA-C-N 114.984 -1.007 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.192 -1.971 0 CA-C-O 121.07 0.462 . . . . 25.0 110.356 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.7 m -112.91 118.16 34.11 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.663 -0.866 . . . . 25.0 108.663 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 30.5 m -134.6 -54.9 0.84 Allowed 'General case' 0 C--O 1.193 -1.9 0 CA-C-O 122.172 0.987 . . . . 50.0 110.964 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.4 m -126.34 122.7 36.16 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-O 122.154 0.978 . . . . 50.0 111.219 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 50.33 34.4 25.84 Favored Glycine 0 N--CA 1.476 1.305 0 O-C-N 119.775 -1.828 . . . . 50.0 116.092 -178.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.5 t80 66.83 -53.4 0.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.092 1.516 . . . . 25.0 115.092 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -84.13 -19.03 34.88 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.91 2.559 . . . . 75.0 117.91 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 54.4 ttm -114.62 150.18 35.48 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.408 1.004 . . . . 25.0 109.67 -172.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 19.3 t -148.5 -48.9 0.16 Allowed 'General case' 0 C--O 1.248 0.991 0 CA-C-O 117.631 -1.176 . . . . 50.0 113.279 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -136.74 114.11 10.13 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 113.646 0.98 . . . . 50.0 113.646 177.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -65.1 151.71 76.47 Favored 'Cis proline' 0 C--N 1.374 1.913 0 C-N-CA 129.722 1.134 . . . . 50.0 112.813 -5.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.68 102.55 14.46 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.238 -1.023 . . . . 50.0 108.238 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.022 0 O-C-N 121.042 -1.036 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 C--O 1.184 -2.385 0 CA-C-O 120.901 0.381 . . . . 25.0 110.298 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.9 p -131.18 179.14 6.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 106.673 -1.603 . . . . 25.0 106.673 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.08 -49.01 0.42 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.684 1.735 . . . . 50.0 115.684 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.35 -44.49 75.14 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 119.293 0.951 . . . . 50.0 113.318 -171.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.52 42.43 0.68 Allowed Glycine 0 C--N 1.31 -0.913 0 N-CA-C 115.387 0.915 . . . . 50.0 115.387 -176.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 61.14 -13.67 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 117.662 2.467 . . . . 25.0 117.662 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -131.7 12.5 4.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.712 0.768 . . . . 75.0 111.575 176.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.8 ttm -152.49 142.45 22.16 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 115.359 -0.837 . . . . 25.0 112.409 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.1 t -164.27 145.13 8.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 50.0 107.569 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 t 35.96 90.47 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 N-CA-C 117.966 2.58 . . . . 50.0 117.966 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -83.19 178.31 28.84 Favored 'Cis proline' 0 CA--C 1.498 -1.297 0 C-N-CA 132.302 2.209 . . . . 50.0 108.755 -4.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.2 t -105.94 97.6 7.4 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.568 -2.382 . . . . 50.0 104.568 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.084 0 O-C-N 121.397 -0.814 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.3 t . . . . . 0 N--CA 1.501 2.081 0 N-CA-C 109.445 -0.576 . . . . 25.0 109.445 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 97.7 m -83.42 117.69 23.22 Favored 'General case' 0 C--O 1.2 -1.501 0 O-C-N 121.375 -0.828 . . . . 25.0 110.23 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.9 m -138.97 -46.31 0.48 Allowed 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 113.246 0.832 . . . . 50.0 113.246 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.81 -60.84 1.76 Allowed 'General case' 0 C--O 1.188 -2.173 0 CA-C-O 122.056 0.931 . . . . 50.0 111.46 -173.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.16 35.41 5.0 Favored Glycine 0 N--CA 1.473 1.154 0 O-C-N 121.03 -1.044 . . . . 50.0 111.234 -170.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.8 t80 62.43 -64.49 0.09 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.668 1.587 . . . . 25.0 114.028 -177.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -87.04 14.72 6.99 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.706 -1.246 . . . . 75.0 112.017 -178.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 49.2 tpp -154.73 152.16 29.57 Favored 'General case' 0 C--O 1.283 2.831 0 O-C-N 121.617 -0.677 . . . . 25.0 111.052 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 t -106.3 -53.81 2.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 114.19 1.182 . . . . 50.0 114.19 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -144.33 160.68 47.74 Favored Pre-proline 0 C--O 1.215 -0.753 0 N-CA-C 105.257 -2.127 . . . . 50.0 105.257 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.64 150.9 96.33 Favored 'Cis proline' 0 C--N 1.372 1.805 0 O-C-N 123.147 1.077 . . . . 75.0 111.075 -5.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -136.72 -69.17 0.47 Allowed 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.415 1.072 . . . . 50.0 111.187 -179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.394 0 O-C-N 121.107 -0.996 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.508 2.451 0 CA-C-O 118.329 -0.843 . . . . 25.0 110.025 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.7 p -73.03 159.82 33.04 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 106.692 -1.596 . . . . 25.0 106.692 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.498 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -137.93 -19.31 1.16 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.088 1.514 . . . . 50.0 115.088 -179.212 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.7 t -147.32 149.84 33.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.035 -0.728 . . . . 50.0 109.035 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.11 -149.23 31.34 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.268 0.94 . . . . 50.0 111.674 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -75.54 -39.74 57.88 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 123.075 1.417 . . . . 25.0 112.573 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.27 15.11 1.14 Allowed 'General case' 0 C--O 1.211 -0.967 0 N-CA-C 116.312 1.968 . . . . 75.0 116.312 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.3 mmt -81.77 -176.87 6.31 Favored 'General case' 0 C--O 1.242 0.686 0 O-C-N 120.592 -1.318 . . . . 25.0 107.82 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.498 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 15.9 t -150.62 179.65 8.0 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 104.006 -2.59 . . . . 50.0 104.006 175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.0 m -68.45 145.65 97.37 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 119.046 0.839 . . . . 50.0 112.416 -173.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -66.21 143.32 61.85 Favored 'Cis proline' 0 CA--C 1.536 0.614 0 C-N-CA 131.759 1.983 . . . . 75.0 110.793 2.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.22 137.72 54.81 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.393 -1.336 . . . . 50.0 107.393 -173.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.096 0 O-C-N 119.056 -2.277 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.608 -0.516 . . . . 25.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -81.55 157.5 24.77 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 107.878 -1.156 . . . . 25.0 107.878 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 8' ' ' MET . 9.3 t -158.03 -154.95 0.47 Allowed 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 106.428 -1.693 . . . . 50.0 106.428 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.68 150.86 39.86 Favored 'General case' 0 C--O 1.261 1.666 0 N-CA-C 107.85 -1.167 . . . . 50.0 107.85 173.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 66.49 -145.49 47.31 Favored Glycine 0 C--O 1.211 -1.301 0 N-CA-C 105.035 -3.226 . . . . 50.0 105.035 -172.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -79.18 -44.96 20.87 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 106.531 -1.655 . . . . 25.0 106.531 164.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.15 134.5 14.27 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 103.742 -2.688 . . . . 75.0 103.742 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.485 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 17.4 ttt -166.05 44.51 0.07 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 105.389 -2.078 . . . . 25.0 105.389 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -88.16 73.92 8.89 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 122.555 1.169 . . . . 50.0 112.191 -175.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -77.86 -11.06 0.17 Allowed Pre-proline 0 CA--C 1.581 2.166 0 N-CA-C 119.451 3.13 . . . . 50.0 119.451 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.37 150.04 87.36 Favored 'Cis proline' 0 N--CA 1.488 1.198 1 C-N-CA 137.469 4.362 . . . . 50.0 115.649 2.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.1 t -79.26 125.62 29.71 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 120.333 -0.547 . . . . 50.0 110.237 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.396 0 O-C-N 122.318 -0.239 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.19 -2.075 0 N-CA-C 109.225 -0.657 . . . . 25.0 109.225 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.8 p -71.88 146.24 48.02 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.791 0.723 . . . . 25.0 110.081 -175.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 14.1 m -126.83 -130.04 0.23 Allowed 'General case' 0 CA--C 1.565 1.552 0 O-C-N 123.869 0.731 . . . . 50.0 110.777 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.9 p -58.97 123.49 16.74 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 116.011 1.856 . . . . 50.0 116.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.64 12.95 74.46 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 120.932 -1.105 . . . . 50.0 115.182 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 64.1 142.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.74 1.216 . . . . 25.0 113.518 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.32 -44.87 0.07 Allowed 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 127.912 2.485 . . . . 75.0 115.888 -174.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 60.3 ttp -68.27 152.24 45.74 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.81 1.644 . . . . 25.0 108.578 175.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.406 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 10.7 t -156.14 -51.9 0.08 Allowed 'General case' 0 C--O 1.207 -1.169 0 N-CA-C 113.883 1.068 . . . . 50.0 113.883 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.3 t -139.33 111.95 7.85 Favored Pre-proline 0 N--CA 1.484 1.243 0 CA-C-O 116.853 -1.546 . . . . 50.0 108.96 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.91 163.7 90.04 Favored 'Cis proline' 0 CA--C 1.553 1.436 0 O-C-N 124.744 1.918 . . . . 50.0 115.091 -5.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.5 m -92.19 115.62 28.23 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 106.611 -1.625 . . . . 50.0 106.611 172.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.044 0 CA-C-N 116.103 -0.499 . . . . 25.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.513 2.705 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -139.9 148.76 42.49 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.5 m -144.33 -32.3 0.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 O-C-N 124.743 1.277 . . . . 0.0 111.832 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.4 m -118.88 123.45 44.72 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.05 -1.031 . . . . 0.0 111.346 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA3' HH21 ' A' ' 7' ' ' ARG . . . 61.23 22.62 61.07 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-O 120.117 -0.268 . . . . 0.0 113.612 178.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 58.38 2.69 0.22 Allowed 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.522 HH21 ' HA3' ' A' ' 5' ' ' GLY . 0.1 OUTLIER -119.39 -6.96 10.27 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -177.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -156.98 167.98 28.85 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.906 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.6 t -127.15 -55.8 1.35 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 120.169 1.35 . . . . 0.0 110.659 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.1 p -145.94 136.28 12.09 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.338 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -65.11 153.08 77.16 Favored 'Cis proline' 0 C--N 1.367 1.513 0 C-N-CA 130.965 1.652 . . . . 0.0 113.019 -5.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.9 t . . . . . 0 C--O 1.211 -0.964 0 O-C-N 124.787 1.304 . . . . 0.0 109.454 178.82 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -131.23 146.87 52.49 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.652 0.66 . . . . 0.0 109.45 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.9 p -153.21 -3.71 0.21 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 123.943 1.83 . . . . 0.0 113.642 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.6 t -125.56 75.54 1.49 Allowed 'General case' 0 C--O 1.255 1.393 0 N-CA-C 104.412 -2.44 . . . . 0.0 104.412 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.78 -172.37 51.79 Favored Glycine 0 C--O 1.272 2.513 0 N-CA-C 103.908 -3.677 . . . . 0.0 103.908 -173.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.95 14.78 22.44 Favored 'General case' 0 C--O 1.195 -1.781 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.263 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.76 -24.15 8.84 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -154.48 -177.9 6.79 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.318 1.011 . . . . 0.0 109.335 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.6 t -134.8 -136.57 0.16 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.2 m -61.15 154.52 61.27 Favored Pre-proline 0 CA--C 1.543 0.694 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.53 -13.82 17.57 Favored 'Cis proline' 0 C--N 1.364 1.385 0 C-N-CA 131.608 1.92 . . . . 0.0 114.685 1.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.478 0.953 0 O-C-N 124.383 1.052 . . . . 0.0 112.309 -175.591 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.21 -1.005 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.1 p -105.61 161.16 14.61 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.1 m -135.06 -30.95 1.02 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -173.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 23.9 p -148.63 158.6 44.25 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.373 -0.829 . . . . 0.0 110.85 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.44 23.62 62.76 Favored Glycine 0 C--O 1.225 -0.41 0 C-N-CA 120.047 -1.073 . . . . 0.0 113.787 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.2 p90 53.76 -21.02 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 118.253 2.686 . . . . 0.0 118.253 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.08 17.38 5.59 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.0 tpp -143.64 154.42 43.52 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.565 -0.709 . . . . 0.0 110.661 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.9 t -130.98 -47.59 1.02 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.116 170.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.4 125.12 18.54 Favored Pre-proline 0 CA--C 1.563 1.464 0 O-C-N 124.199 0.937 . . . . 0.0 110.642 -178.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.68 168.6 76.69 Favored 'Cis proline' 0 C--N 1.368 1.589 0 C-N-CA 129.384 0.993 . . . . 0.0 110.718 -4.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 C--N 1.328 -0.366 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -177.767 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.496 1.846 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -137.51 156.7 47.83 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.428 1.013 . . . . 0.0 111.197 -173.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.7 p -158.1 -21.72 0.08 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 69.4 m -112.92 35.02 4.08 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -175.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.31 -172.4 23.84 Favored Glycine 0 C--N 1.315 -0.62 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -65.15 -30.74 71.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.95 -7.53 3.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 117.182 2.289 . . . . 0.0 117.182 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.3 ptp -119.54 156.45 30.28 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.883 -1.136 . . . . 0.0 112.481 -172.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 t -157.81 90.83 1.09 Allowed 'General case' 0 C--O 1.211 -0.93 0 C-N-CA 124.156 0.982 . . . . 0.0 110.829 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 62.77 102.86 0.03 OUTLIER Pre-proline 0 C--O 1.208 -1.09 0 C-N-CA 125.027 1.331 . . . . 0.0 113.129 -175.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.36 155.72 43.21 Favored 'Cis proline' 0 C--N 1.356 0.945 0 N-CA-C 115.681 1.377 . . . . 0.0 115.681 -0.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 C--N 1.312 -1.047 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.68 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.214 -0.812 0 CA-C-O 119.213 -0.423 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.7 t -146.49 155.33 42.45 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.593 1.088 . . . . 0.0 110.954 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -142.58 -6.23 0.91 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.0 m -134.25 106.56 7.2 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.57 -152.62 41.39 Favored Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 107.524 -2.23 . . . . 0.0 107.524 -177.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -113.93 19.69 16.35 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 117.781 0.79 . . . . 0.0 112.881 -175.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.72 -3.71 0.1 Allowed 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -175.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 ttm -133.01 152.18 51.99 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -171.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.4 t -154.77 136.1 14.08 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.4 t 24.94 104.45 0.01 OUTLIER Pre-proline 0 CA--C 1.562 1.435 0 N-CA-C 119.541 3.163 . . . . 0.0 119.541 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.48 156.05 89.76 Favored 'Cis proline' 0 C--N 1.36 1.164 0 C-N-CA 133.431 2.68 . . . . 0.0 114.238 3.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 104.767 -2.308 . . . . 0.0 104.767 177.883 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -72.46 128.83 36.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.2 t -158.9 -175.28 5.2 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -50.26 141.42 11.57 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 122.03 0.919 . . . . 0.0 112.002 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.76 38.94 96.77 Favored Glycine 0 C--O 1.197 -2.16 0 C-N-CA 120.074 -1.06 . . . . 0.0 111.085 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 60.92 -51.46 0.1 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 127.75 2.42 . . . . 0.0 116.062 -177.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.91 -13.22 1.24 Allowed 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.443 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.9 ptp -73.5 -30.21 62.98 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.335 1.425 . . . . 0.0 113.812 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 t 63.16 -60.16 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 N-CA-C 117.33 2.345 . . . . 0.0 117.33 174.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.35 129.93 9.67 Favored Pre-proline 0 C--O 1.205 -1.261 0 CA-C-N 119.758 1.163 . . . . 0.0 110.233 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -69.88 151.83 92.09 Favored 'Cis proline' 0 C--N 1.355 0.892 0 C-N-CA 129.822 1.176 . . . . 0.0 113.856 -4.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t . . . . . 0 C--O 1.217 -0.638 0 C-N-CA 125.042 1.337 . . . . 0.0 110.808 -178.7 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.782 0.325 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.7 p -80.43 157.54 26.21 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.065 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -138.62 -15.89 1.18 Allowed 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.9 t -136.61 112.34 9.46 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.99 -150.63 47.92 Favored Glycine 0 C--O 1.187 -2.806 0 N-CA-C 104.708 -3.357 . . . . 0.0 104.708 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -122.59 21.91 10.0 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.132 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 2.23 3.44 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -178.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.3 ptm -158.94 161.58 36.76 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.4 t -147.41 99.75 3.17 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.529 ' H ' ' HA ' ' A' ' 11' ' ' PRO . 57.7 t -121.02 -50.89 0.04 OUTLIER Pre-proline 0 C--N 1.318 -0.803 0 O-C-N 123.508 0.505 . . . . 0.0 111.833 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.529 ' HA ' ' H ' ' A' ' 10' ' ' VAL . 26.5 Cg_endo -88.14 171.83 32.51 Favored 'Cis proline' 0 CA--C 1.565 2.057 1 C-N-CA 138.464 4.777 . . . . 0.0 111.533 -2.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.2 m . . . . . 0 C--O 1.19 -2.075 0 C-N-CA 123.752 0.821 . . . . 0.0 110.638 -179.83 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.3 p -129.57 169.14 15.39 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -147.45 10.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.6 t -146.36 62.05 1.22 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.04 171.07 47.33 Favored Glycine 0 C--O 1.204 -1.726 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.766 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -57.25 -26.66 61.13 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 117.622 0.711 . . . . 0.0 112.541 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 -6.9 20.47 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 -173.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.17 168.84 21.4 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.94 150.44 36.99 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.73 141.11 97.16 Favored Pre-proline 0 C--O 1.218 -0.584 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -66.09 126.48 6.89 Favored 'Cis proline' 0 C--O 1.202 -1.299 0 C-N-CA 132.736 2.39 . . . . 0.0 110.756 -2.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 C--O 1.217 -0.624 0 CA-C-N 113.286 -1.779 . . . . 0.0 110.895 -178.485 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.59 143.64 44.22 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 103.763 -2.68 . . . . 0.0 103.763 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.4 p -142.13 -7.98 0.91 Allowed 'General case' 0 C--O 1.246 0.897 0 O-C-N 125.283 1.614 . . . . 0.0 114.367 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.0 m -122.78 86.07 2.52 Favored 'General case' 0 C--O 1.211 -0.929 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.71 -164.42 53.1 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 106.986 -2.446 . . . . 0.0 106.986 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -102.02 25.73 8.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.009 -0.7 . . . . 0.0 109.12 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.86 -8.8 1.84 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.3 ttp -150.36 166.91 28.61 Favored 'General case' 0 C--O 1.272 2.238 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.125 -175.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.2 t -163.42 -42.42 0.03 OUTLIER 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.501 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.0 t -128.64 120.84 20.87 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.981 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -84.98 166.13 57.53 Favored 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 129.899 1.208 . . . . 0.0 111.323 -10.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 173.661 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.0 t -139.65 143.51 37.2 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 104.707 -2.331 . . . . 0.0 104.707 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.7 p -163.94 -34.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.116 1.51 . . . . 0.0 114.6 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.3 p -95.3 -14.85 23.59 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.38 61.36 0.1 Allowed Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 118.878 2.311 . . . . 0.0 118.878 -175.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 83.1 t80 62.97 -47.88 0.2 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.433 ' H ' ' HD3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -122.58 7.57 9.49 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -179.851 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.0 mtt -143.98 156.95 44.6 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.0 t -142.77 -178.93 6.04 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 102.323 -3.214 . . . . 0.0 102.323 176.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.18 131.36 60.37 Favored Pre-proline 0 CA--C 1.573 1.849 0 CA-C-N 119.491 1.041 . . . . 0.0 112.238 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -67.34 132.11 17.54 Favored 'Cis proline' 0 C--N 1.381 2.264 0 C-N-CA 131.19 1.746 . . . . 0.0 114.502 -0.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 N--CA 1.488 1.467 0 O-C-N 120.766 -1.209 . . . . 0.0 110.516 -176.179 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.2 t -145.21 146.15 31.61 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.0 p -154.67 -6.24 0.14 Allowed 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.557 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 25.3 p -152.18 155.25 37.43 Favored 'General case' 0 C--O 1.293 3.37 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.682 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.52 21.06 40.56 Favored Glycine 0 CA--C 1.546 1.972 0 C-N-CA 119.464 -1.351 . . . . 0.0 114.929 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.7 t80 65.21 -19.97 0.08 Allowed 'General case' 0 C--O 1.201 -1.457 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.12 25.01 0.91 Allowed 'General case' 0 CA--C 1.56 1.328 0 O-C-N 121.118 -0.989 . . . . 0.0 113.275 -175.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.2 tpp -135.67 154.13 51.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.005 -1.06 . . . . 0.0 109.806 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.7 t -162.8 149.88 13.16 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 m 28.31 85.36 0.13 Allowed Pre-proline 0 N--CA 1.483 1.208 0 N-CA-C 118.357 2.725 . . . . 0.0 118.357 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -87.02 173.84 31.46 Favored 'Cis proline' 0 CA--C 1.486 -1.881 0 C-N-CA 131.376 1.823 . . . . 0.0 111.746 0.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m . . . . . 0 CA--C 1.556 1.183 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 175.885 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.495 1.783 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.8 t -155.24 141.18 18.24 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 117.405 -1.283 . . . . 0.0 108.727 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 p -129.98 -4.65 4.52 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 124.905 1.378 . . . . 0.0 109.079 176.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.6 t -133.05 100.87 5.01 Favored 'General case' 0 C--O 1.263 1.782 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -178.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.24 -153.48 49.58 Favored Glycine 0 C--O 1.21 -1.367 0 C-N-CA 119.529 -1.319 . . . . 0.0 111.656 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -100.61 0.79 39.92 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.52 -10.66 4.04 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -175.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.6 mtp -144.2 -179.56 6.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 120.229 1.377 . . . . 0.0 114.239 -169.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -152.41 -179.4 7.53 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 102.043 -3.317 . . . . 0.0 102.043 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 t -60.4 132.77 90.78 Favored Pre-proline 0 CA--C 1.56 1.328 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.339 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.71 132.16 23.92 Favored 'Cis proline' 0 C--O 1.21 -0.897 0 C-N-CA 130.453 1.439 . . . . 0.0 113.297 6.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.467 0.424 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.293 -178.886 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -138.24 144.74 40.72 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 123.342 1.544 . . . . 0.0 109.919 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 p -159.09 -6.85 0.07 Allowed 'General case' 0 CA--C 1.576 1.957 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.186 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.1 t -122.74 95.34 4.59 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 102.574 -3.121 . . . . 0.0 102.574 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.92 -159.8 53.87 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 107.197 -2.361 . . . . 0.0 107.197 -169.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -114.62 28.43 8.73 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 122.134 -0.627 . . . . 0.0 112.112 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.31 -27.85 2.64 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ptp -154.58 176.07 12.85 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.334 -1.479 . . . . 0.0 111.984 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.3 t -126.46 -176.43 3.67 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.6 t -61.35 134.16 93.27 Favored Pre-proline 0 N--CA 1.482 1.153 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.47 120.33 7.14 Favored 'Cis proline' 0 C--N 1.353 0.767 0 C-N-CA 131.92 2.05 . . . . 0.0 112.049 2.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 C--O 1.214 -0.783 0 CA-C-O 122.576 1.179 . . . . 0.0 112.377 -173.871 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 118.365 -0.826 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.6 m -81.37 136.19 35.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.263 0.938 . . . . 0.0 108.52 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.51 -142.86 0.13 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.544 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.3 m -66.92 137.37 56.5 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.003 -177.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.6 22.57 46.6 Favored Glycine 0 N--CA 1.478 1.495 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 60.45 12.29 3.42 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.16 1.784 . . . . 0.0 113.246 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -140.36 -65.27 0.46 Allowed 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.8 ttp -82.63 143.26 31.1 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -171.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.36 -14.58 6.4 Favored 'General case' 0 C--O 1.206 -1.207 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.513 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -134.29 124.15 17.07 Favored Pre-proline 0 C--N 1.321 -0.661 0 O-C-N 121.817 -0.552 . . . . 0.0 110.693 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -94.86 8.67 49.53 Favored 'Cis proline' 0 C--O 1.254 1.276 0 C-N-CA 133.647 2.77 . . . . 0.0 113.558 -2.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.9 m . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 123.165 1.459 . . . . 0.0 111.351 -176.862 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.192 -1.971 0 CA-C-O 121.07 0.462 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.566 HG23 ' HA ' ' A' ' 6' ' ' TYR . 18.7 m -112.91 118.16 34.11 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 30.5 m -134.6 -54.9 0.84 Allowed 'General case' 0 C--O 1.193 -1.9 0 CA-C-O 122.172 0.987 . . . . 0.0 110.964 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.4 m -126.34 122.7 36.16 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-O 122.154 0.978 . . . . 0.0 111.219 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 50.33 34.4 25.84 Favored Glycine 0 N--CA 1.476 1.305 0 O-C-N 119.775 -1.828 . . . . 0.0 116.092 -178.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.566 ' HA ' HG23 ' A' ' 2' ' ' THR . 86.5 t80 66.83 -53.4 0.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -84.13 -19.03 34.88 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.91 2.559 . . . . 0.0 117.91 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 54.4 ttm -114.62 150.18 35.48 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.408 1.004 . . . . 0.0 109.67 -172.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 19.3 t -148.5 -48.9 0.16 Allowed 'General case' 0 C--O 1.248 0.991 0 CA-C-O 117.631 -1.176 . . . . 0.0 113.279 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -136.74 114.11 10.13 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -65.1 151.71 76.47 Favored 'Cis proline' 0 C--N 1.374 1.913 0 C-N-CA 129.722 1.134 . . . . 0.0 112.813 -5.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.5 t . . . . . 0 C--N 1.302 -1.49 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.396 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 C--O 1.184 -2.385 0 CA-C-O 120.901 0.381 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.9 p -131.18 179.14 6.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.08 -49.01 0.42 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.35 -44.49 75.14 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 119.293 0.951 . . . . 0.0 113.318 -171.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.52 42.43 0.68 Allowed Glycine 0 C--N 1.31 -0.913 0 N-CA-C 115.387 0.915 . . . . 0.0 115.387 -176.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 61.14 -13.67 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -131.7 12.5 4.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.712 0.768 . . . . 0.0 111.575 176.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.8 ttm -152.49 142.45 22.16 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.409 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.1 t -164.27 145.13 8.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 t 35.96 90.47 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -83.19 178.31 28.84 Favored 'Cis proline' 0 CA--C 1.498 -1.297 0 C-N-CA 132.302 2.209 . . . . 0.0 108.755 -4.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.436 -1.144 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.693 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.3 t . . . . . 0 N--CA 1.501 2.081 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.503 HG23 ' HA ' ' A' ' 6' ' ' TYR . 97.7 m -83.42 117.69 23.22 Favored 'General case' 0 C--O 1.2 -1.501 0 O-C-N 121.375 -0.828 . . . . 0.0 110.23 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -138.97 -46.31 0.48 Allowed 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 174.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.81 -60.84 1.76 Allowed 'General case' 0 C--O 1.188 -2.173 0 CA-C-O 122.056 0.931 . . . . 0.0 111.46 -173.366 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.16 35.41 5.0 Favored Glycine 0 N--CA 1.473 1.154 0 O-C-N 121.03 -1.044 . . . . 0.0 111.234 -170.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG23 ' A' ' 2' ' ' THR . 9.8 t80 62.43 -64.49 0.09 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.668 1.587 . . . . 0.0 114.028 -177.403 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -87.04 14.72 6.99 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.706 -1.246 . . . . 0.0 112.017 -178.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 49.2 tpp -154.73 152.16 29.57 Favored 'General case' 0 C--O 1.283 2.831 0 O-C-N 121.617 -0.677 . . . . 0.0 111.052 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 21.3 t -106.3 -53.81 2.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 176.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -144.33 160.68 47.74 Favored Pre-proline 0 C--O 1.215 -0.753 0 N-CA-C 105.257 -2.127 . . . . 0.0 105.257 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.64 150.9 96.33 Favored 'Cis proline' 0 C--N 1.372 1.805 0 O-C-N 123.147 1.077 . . . . 0.0 111.075 -5.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.215 -0.712 0 O-C-N 124.415 1.072 . . . . 0.0 111.187 -179.198 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.508 2.451 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.7 p -73.03 159.82 33.04 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -137.93 -19.31 1.16 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -179.212 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.7 t -147.32 149.84 33.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.11 -149.23 31.34 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -75.54 -39.74 57.88 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 123.075 1.417 . . . . 0.0 112.573 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.27 15.11 1.14 Allowed 'General case' 0 C--O 1.211 -0.967 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.3 mmt -81.77 -176.87 6.31 Favored 'General case' 0 C--O 1.242 0.686 0 O-C-N 120.592 -1.318 . . . . 0.0 107.82 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 15.9 t -150.62 179.65 8.0 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.0 m -68.45 145.65 97.37 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 119.046 0.839 . . . . 0.0 112.416 -173.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -66.21 143.32 61.85 Favored 'Cis proline' 0 CA--C 1.536 0.614 0 C-N-CA 131.759 1.983 . . . . 0.0 110.793 2.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -173.392 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -81.55 157.5 24.77 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 8' ' ' MET . 9.3 t -158.03 -154.95 0.47 Allowed 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.68 150.86 39.86 Favored 'General case' 0 C--O 1.261 1.666 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 173.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 66.49 -145.49 47.31 Favored Glycine 0 C--O 1.211 -1.301 0 N-CA-C 105.035 -3.226 . . . . 0.0 105.035 -172.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -79.18 -44.96 20.87 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 164.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.15 134.5 14.27 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.495 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 17.4 ttt -166.05 44.51 0.07 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -88.16 73.92 8.89 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 122.555 1.169 . . . . 0.0 112.191 -175.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -77.86 -11.06 0.17 Allowed Pre-proline 0 CA--C 1.581 2.166 0 N-CA-C 119.451 3.13 . . . . 0.0 119.451 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.37 150.04 87.36 Favored 'Cis proline' 0 N--CA 1.488 1.198 1 C-N-CA 137.469 4.362 . . . . 0.0 115.649 2.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.473 0.71 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.237 177.667 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.19 -2.075 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.8 p -71.88 146.24 48.02 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.791 0.723 . . . . 0.0 110.081 -175.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 14.1 m -126.83 -130.04 0.23 Allowed 'General case' 0 CA--C 1.565 1.552 0 O-C-N 123.869 0.731 . . . . 0.0 110.777 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.9 p -58.97 123.49 16.74 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.64 12.95 74.46 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 120.932 -1.105 . . . . 0.0 115.182 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 64.1 142.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.74 1.216 . . . . 0.0 113.518 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.32 -44.87 0.07 Allowed 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 127.912 2.485 . . . . 0.0 115.888 -174.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 60.3 ttp -68.27 152.24 45.74 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.81 1.644 . . . . 0.0 108.578 175.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 10.7 t -156.14 -51.9 0.08 Allowed 'General case' 0 C--O 1.207 -1.169 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.3 t -139.33 111.95 7.85 Favored Pre-proline 0 N--CA 1.484 1.243 0 CA-C-O 116.853 -1.546 . . . . 0.0 108.96 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.91 163.7 90.04 Favored 'Cis proline' 0 CA--C 1.553 1.436 0 O-C-N 124.744 1.918 . . . . 0.0 115.091 -5.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.5 m . . . . . 0 C--O 1.211 -0.957 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 172.434 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.513 2.705 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -139.9 148.76 42.49 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.5 m -144.33 -32.3 0.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 O-C-N 124.743 1.277 . . . . 0.0 111.832 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.4 m -118.88 123.45 44.72 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.05 -1.031 . . . . 0.0 111.346 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA3' HH21 ' A' ' 7' ' ' ARG . . . 61.23 22.62 61.07 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-O 120.117 -0.268 . . . . 0.0 113.612 178.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 58.38 2.69 0.22 Allowed 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.522 HH21 ' HA3' ' A' ' 5' ' ' GLY . 0.1 OUTLIER -119.39 -6.96 10.27 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -177.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -156.98 167.98 28.85 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.906 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.6 t -127.15 -55.8 1.35 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 120.169 1.35 . . . . 0.0 110.659 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.1 p -145.94 136.28 12.09 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.338 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -65.11 153.08 77.16 Favored 'Cis proline' 0 C--N 1.367 1.513 0 C-N-CA 130.965 1.652 . . . . 0.0 113.019 -5.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.9 t -143.01 130.11 20.75 Favored 'General case' 0 C--O 1.211 -0.964 0 O-C-N 124.787 1.304 . . . . 0.0 109.454 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.679 0 O-C-N 121.226 -0.921 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -131.23 146.87 52.49 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.652 0.66 . . . . 0.0 109.45 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.9 p -153.21 -3.71 0.21 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 123.943 1.83 . . . . 0.0 113.642 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.6 t -125.56 75.54 1.49 Allowed 'General case' 0 C--O 1.255 1.393 0 N-CA-C 104.412 -2.44 . . . . 0.0 104.412 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.78 -172.37 51.79 Favored Glycine 0 C--O 1.272 2.513 0 N-CA-C 103.908 -3.677 . . . . 0.0 103.908 -173.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.95 14.78 22.44 Favored 'General case' 0 C--O 1.195 -1.781 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.263 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.76 -24.15 8.84 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -154.48 -177.9 6.79 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.318 1.011 . . . . 0.0 109.335 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.6 t -134.8 -136.57 0.16 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.2 m -61.15 154.52 61.27 Favored Pre-proline 0 CA--C 1.543 0.694 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.53 -13.82 17.57 Favored 'Cis proline' 0 C--N 1.364 1.385 0 C-N-CA 131.608 1.92 . . . . 0.0 114.685 1.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.1 t 53.5 56.51 7.22 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 124.383 1.052 . . . . 0.0 112.309 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.05 0 O-C-N 119.392 -2.067 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.21 -1.005 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.1 p -105.61 161.16 14.61 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.1 m -135.06 -30.95 1.02 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -173.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 23.9 p -148.63 158.6 44.25 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.373 -0.829 . . . . 0.0 110.85 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.44 23.62 62.76 Favored Glycine 0 C--O 1.225 -0.41 0 C-N-CA 120.047 -1.073 . . . . 0.0 113.787 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.2 p90 53.76 -21.02 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 118.253 2.686 . . . . 0.0 118.253 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.08 17.38 5.59 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.0 tpp -143.64 154.42 43.52 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.565 -0.709 . . . . 0.0 110.661 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.9 t -130.98 -47.59 1.02 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.116 170.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.4 125.12 18.54 Favored Pre-proline 0 CA--C 1.563 1.464 0 O-C-N 124.199 0.937 . . . . 0.0 110.642 -178.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.68 168.6 76.69 Favored 'Cis proline' 0 C--N 1.368 1.589 0 C-N-CA 129.384 0.993 . . . . 0.0 110.718 -4.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.9 t -136.86 127.87 27.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.595 0 O-C-N 121.144 -0.972 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.496 1.846 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -137.51 156.7 47.83 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.428 1.013 . . . . 0.0 111.197 -173.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.7 p -158.1 -21.72 0.08 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 69.4 m -112.92 35.02 4.08 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -175.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.31 -172.4 23.84 Favored Glycine 0 C--N 1.315 -0.62 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -65.15 -30.74 71.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.95 -7.53 3.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 117.182 2.289 . . . . 0.0 117.182 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.3 ptp -119.54 156.45 30.28 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.883 -1.136 . . . . 0.0 112.481 -172.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 t -157.81 90.83 1.09 Allowed 'General case' 0 C--O 1.211 -0.93 0 C-N-CA 124.156 0.982 . . . . 0.0 110.829 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 62.77 102.86 0.03 OUTLIER Pre-proline 0 C--O 1.208 -1.09 0 C-N-CA 125.027 1.331 . . . . 0.0 113.129 -175.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.36 155.72 43.21 Favored 'Cis proline' 0 C--N 1.356 0.945 0 N-CA-C 115.681 1.377 . . . . 0.0 115.681 -0.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.5 m -127.09 131.0 50.95 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.68 0 O-C-N 124.009 0.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.214 -0.812 0 CA-C-O 119.213 -0.423 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.7 t -146.49 155.33 42.45 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.593 1.088 . . . . 0.0 110.954 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -142.58 -6.23 0.91 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.0 m -134.25 106.56 7.2 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.57 -152.62 41.39 Favored Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 107.524 -2.23 . . . . 0.0 107.524 -177.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -113.93 19.69 16.35 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 117.781 0.79 . . . . 0.0 112.881 -175.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.72 -3.71 0.1 Allowed 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -175.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 ttm -133.01 152.18 51.99 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -171.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.4 t -154.77 136.1 14.08 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.4 t 24.94 104.45 0.01 OUTLIER Pre-proline 0 CA--C 1.562 1.435 0 N-CA-C 119.541 3.163 . . . . 0.0 119.541 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.48 156.05 89.76 Favored 'Cis proline' 0 C--N 1.36 1.164 0 C-N-CA 133.431 2.68 . . . . 0.0 114.238 3.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.2 p -172.02 165.66 6.25 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 104.767 -2.308 . . . . 0.0 104.767 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.373 1.624 0 O-C-N 119.574 -1.953 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -72.46 128.83 36.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.2 t -158.9 -175.28 5.2 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -50.26 141.42 11.57 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 122.03 0.919 . . . . 0.0 112.002 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.76 38.94 96.77 Favored Glycine 0 C--O 1.197 -2.16 0 C-N-CA 120.074 -1.06 . . . . 0.0 111.085 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 60.92 -51.46 0.1 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 127.75 2.42 . . . . 0.0 116.062 -177.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.91 -13.22 1.24 Allowed 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.443 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.9 ptp -73.5 -30.21 62.98 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.335 1.425 . . . . 0.0 113.812 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 t 63.16 -60.16 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 N-CA-C 117.33 2.345 . . . . 0.0 117.33 174.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.35 129.93 9.67 Favored Pre-proline 0 C--O 1.205 -1.261 0 CA-C-N 119.758 1.163 . . . . 0.0 110.233 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -69.88 151.83 92.09 Favored 'Cis proline' 0 C--N 1.355 0.892 0 C-N-CA 129.822 1.176 . . . . 0.0 113.856 -4.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -104.17 114.67 29.07 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 125.042 1.337 . . . . 0.0 110.808 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.841 0 O-C-N 121.268 -0.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.782 0.325 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.7 p -80.43 157.54 26.21 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.065 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -138.62 -15.89 1.18 Allowed 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.9 t -136.61 112.34 9.46 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.99 -150.63 47.92 Favored Glycine 0 C--O 1.187 -2.806 0 N-CA-C 104.708 -3.357 . . . . 0.0 104.708 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -122.59 21.91 10.0 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.132 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 2.23 3.44 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -178.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.3 ptm -158.94 161.58 36.76 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.4 t -147.41 99.75 3.17 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.529 ' H ' ' HA ' ' A' ' 11' ' ' PRO . 57.7 t -121.02 -50.89 0.04 OUTLIER Pre-proline 0 C--N 1.318 -0.803 0 O-C-N 123.508 0.505 . . . . 0.0 111.833 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.529 ' HA ' ' H ' ' A' ' 10' ' ' VAL . 26.5 Cg_endo -88.14 171.83 32.51 Favored 'Cis proline' 0 CA--C 1.565 2.057 1 C-N-CA 138.464 4.777 . . . . 0.0 111.533 -2.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.2 m -68.2 156.12 38.24 Favored 'General case' 0 C--O 1.19 -2.075 0 C-N-CA 123.752 0.821 . . . . 0.0 110.638 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.101 0 O-C-N 121.856 -0.527 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.3 p -129.57 169.14 15.39 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -147.45 10.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.6 t -146.36 62.05 1.22 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.04 171.07 47.33 Favored Glycine 0 C--O 1.204 -1.726 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.766 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -57.25 -26.66 61.13 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 117.622 0.711 . . . . 0.0 112.541 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 -6.9 20.47 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 -173.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.17 168.84 21.4 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.94 150.44 36.99 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.73 141.11 97.16 Favored Pre-proline 0 C--O 1.218 -0.584 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -66.09 126.48 6.89 Favored 'Cis proline' 0 C--O 1.202 -1.299 0 C-N-CA 132.736 2.39 . . . . 0.0 110.756 -2.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.7 p -138.36 14.1 2.79 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 113.286 -1.779 . . . . 0.0 110.895 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 0.376 0 O-C-N 119.803 -1.811 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.59 143.64 44.22 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 103.763 -2.68 . . . . 0.0 103.763 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.4 p -142.13 -7.98 0.91 Allowed 'General case' 0 C--O 1.246 0.897 0 O-C-N 125.283 1.614 . . . . 0.0 114.367 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.0 m -122.78 86.07 2.52 Favored 'General case' 0 C--O 1.211 -0.929 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.71 -164.42 53.1 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 106.986 -2.446 . . . . 0.0 106.986 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -102.02 25.73 8.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.009 -0.7 . . . . 0.0 109.12 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.86 -8.8 1.84 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.3 ttp -150.36 166.91 28.61 Favored 'General case' 0 C--O 1.272 2.238 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.125 -175.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.2 t -163.42 -42.42 0.03 OUTLIER 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.501 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.0 t -128.64 120.84 20.87 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.981 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -84.98 166.13 57.53 Favored 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 129.899 1.208 . . . . 0.0 111.323 -10.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -139.14 156.0 47.45 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 173.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 O-C-N 121.025 -1.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.0 t -139.65 143.51 37.2 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 104.707 -2.331 . . . . 0.0 104.707 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.7 p -163.94 -34.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.116 1.51 . . . . 0.0 114.6 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.3 p -95.3 -14.85 23.59 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.38 61.36 0.1 Allowed Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 118.878 2.311 . . . . 0.0 118.878 -175.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 83.1 t80 62.97 -47.88 0.2 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.433 ' H ' ' HD3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -122.58 7.57 9.49 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -179.851 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.0 mtt -143.98 156.95 44.6 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.0 t -142.77 -178.93 6.04 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 102.323 -3.214 . . . . 0.0 102.323 176.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.18 131.36 60.37 Favored Pre-proline 0 CA--C 1.573 1.849 0 CA-C-N 119.491 1.041 . . . . 0.0 112.238 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -67.34 132.11 17.54 Favored 'Cis proline' 0 C--N 1.381 2.264 0 C-N-CA 131.19 1.746 . . . . 0.0 114.502 -0.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.2 t -114.63 144.41 43.45 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.766 -1.209 . . . . 0.0 110.516 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.776 0 O-C-N 121.534 -0.728 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.2 t -145.21 146.15 31.61 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.0 p -154.67 -6.24 0.14 Allowed 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.557 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 25.3 p -152.18 155.25 37.43 Favored 'General case' 0 C--O 1.293 3.37 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.682 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.52 21.06 40.56 Favored Glycine 0 CA--C 1.546 1.972 0 C-N-CA 119.464 -1.351 . . . . 0.0 114.929 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.7 t80 65.21 -19.97 0.08 Allowed 'General case' 0 C--O 1.201 -1.457 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.12 25.01 0.91 Allowed 'General case' 0 CA--C 1.56 1.328 0 O-C-N 121.118 -0.989 . . . . 0.0 113.275 -175.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.2 tpp -135.67 154.13 51.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.005 -1.06 . . . . 0.0 109.806 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.7 t -162.8 149.88 13.16 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 m 28.31 85.36 0.13 Allowed Pre-proline 0 N--CA 1.483 1.208 0 N-CA-C 118.357 2.725 . . . . 0.0 118.357 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -87.02 173.84 31.46 Favored 'Cis proline' 0 CA--C 1.486 -1.881 0 C-N-CA 131.376 1.823 . . . . 0.0 111.746 0.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -110.04 169.37 8.77 Favored 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.284 0 O-C-N 121.538 -0.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.495 1.783 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.8 t -155.24 141.18 18.24 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 117.405 -1.283 . . . . 0.0 108.727 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 p -129.98 -4.65 4.52 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 124.905 1.378 . . . . 0.0 109.079 176.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.6 t -133.05 100.87 5.01 Favored 'General case' 0 C--O 1.263 1.782 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -178.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.24 -153.48 49.58 Favored Glycine 0 C--O 1.21 -1.367 0 C-N-CA 119.529 -1.319 . . . . 0.0 111.656 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -100.61 0.79 39.92 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.52 -10.66 4.04 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -175.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.6 mtp -144.2 -179.56 6.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 120.229 1.377 . . . . 0.0 114.239 -169.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -152.41 -179.4 7.53 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 102.043 -3.317 . . . . 0.0 102.043 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 t -60.4 132.77 90.78 Favored Pre-proline 0 CA--C 1.56 1.328 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.339 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.71 132.16 23.92 Favored 'Cis proline' 0 C--O 1.21 -0.897 0 C-N-CA 130.453 1.439 . . . . 0.0 113.297 6.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.04 147.18 27.51 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.293 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 116.757 -0.201 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -138.24 144.74 40.72 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 123.342 1.544 . . . . 0.0 109.919 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 p -159.09 -6.85 0.07 Allowed 'General case' 0 CA--C 1.576 1.957 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.186 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.1 t -122.74 95.34 4.59 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 102.574 -3.121 . . . . 0.0 102.574 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.92 -159.8 53.87 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 107.197 -2.361 . . . . 0.0 107.197 -169.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -114.62 28.43 8.73 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 122.134 -0.627 . . . . 0.0 112.112 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.31 -27.85 2.64 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ptp -154.58 176.07 12.85 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.334 -1.479 . . . . 0.0 111.984 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.3 t -126.46 -176.43 3.67 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.6 t -61.35 134.16 93.27 Favored Pre-proline 0 N--CA 1.482 1.153 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.47 120.33 7.14 Favored 'Cis proline' 0 C--N 1.353 0.767 0 C-N-CA 131.92 2.05 . . . . 0.0 112.049 2.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.5 t -95.77 128.53 42.72 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-O 122.576 1.179 . . . . 0.0 112.377 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 O-C-N 120.373 -1.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 118.365 -0.826 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.6 m -81.37 136.19 35.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.263 0.938 . . . . 0.0 108.52 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.51 -142.86 0.13 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.544 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.3 m -66.92 137.37 56.5 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.003 -177.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.6 22.57 46.6 Favored Glycine 0 N--CA 1.478 1.495 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 60.45 12.29 3.42 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.16 1.784 . . . . 0.0 113.246 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -140.36 -65.27 0.46 Allowed 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.8 ttp -82.63 143.26 31.1 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -171.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.36 -14.58 6.4 Favored 'General case' 0 C--O 1.206 -1.207 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.513 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -134.29 124.15 17.07 Favored Pre-proline 0 C--N 1.321 -0.661 0 O-C-N 121.817 -0.552 . . . . 0.0 110.693 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -94.86 8.67 49.53 Favored 'Cis proline' 0 C--O 1.254 1.276 0 C-N-CA 133.647 2.77 . . . . 0.0 113.558 -2.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.9 m 53.69 53.56 11.25 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 123.165 1.459 . . . . 0.0 111.351 -176.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.512 0 CA-C-N 114.984 -1.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.192 -1.971 0 CA-C-O 121.07 0.462 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.566 HG23 ' HA ' ' A' ' 6' ' ' TYR . 18.7 m -112.91 118.16 34.11 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 30.5 m -134.6 -54.9 0.84 Allowed 'General case' 0 C--O 1.193 -1.9 0 CA-C-O 122.172 0.987 . . . . 0.0 110.964 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.4 m -126.34 122.7 36.16 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-O 122.154 0.978 . . . . 0.0 111.219 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 50.33 34.4 25.84 Favored Glycine 0 N--CA 1.476 1.305 0 O-C-N 119.775 -1.828 . . . . 0.0 116.092 -178.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.566 ' HA ' HG23 ' A' ' 2' ' ' THR . 86.5 t80 66.83 -53.4 0.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -84.13 -19.03 34.88 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.91 2.559 . . . . 0.0 117.91 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 54.4 ttm -114.62 150.18 35.48 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.408 1.004 . . . . 0.0 109.67 -172.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 19.3 t -148.5 -48.9 0.16 Allowed 'General case' 0 C--O 1.248 0.991 0 CA-C-O 117.631 -1.176 . . . . 0.0 113.279 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -136.74 114.11 10.13 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -65.1 151.71 76.47 Favored 'Cis proline' 0 C--N 1.374 1.913 0 C-N-CA 129.722 1.134 . . . . 0.0 112.813 -5.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.68 102.55 14.46 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.022 0 O-C-N 121.042 -1.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 C--O 1.184 -2.385 0 CA-C-O 120.901 0.381 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.9 p -131.18 179.14 6.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.08 -49.01 0.42 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.35 -44.49 75.14 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 119.293 0.951 . . . . 0.0 113.318 -171.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.52 42.43 0.68 Allowed Glycine 0 C--N 1.31 -0.913 0 N-CA-C 115.387 0.915 . . . . 0.0 115.387 -176.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 61.14 -13.67 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -131.7 12.5 4.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.712 0.768 . . . . 0.0 111.575 176.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.8 ttm -152.49 142.45 22.16 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.409 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.1 t -164.27 145.13 8.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 t 35.96 90.47 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -83.19 178.31 28.84 Favored 'Cis proline' 0 CA--C 1.498 -1.297 0 C-N-CA 132.302 2.209 . . . . 0.0 108.755 -4.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.2 t -105.94 97.6 7.4 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.084 0 O-C-N 121.397 -0.814 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.3 t . . . . . 0 N--CA 1.501 2.081 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.503 HG23 ' HA ' ' A' ' 6' ' ' TYR . 97.7 m -83.42 117.69 23.22 Favored 'General case' 0 C--O 1.2 -1.501 0 O-C-N 121.375 -0.828 . . . . 0.0 110.23 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -138.97 -46.31 0.48 Allowed 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 174.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.81 -60.84 1.76 Allowed 'General case' 0 C--O 1.188 -2.173 0 CA-C-O 122.056 0.931 . . . . 0.0 111.46 -173.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.16 35.41 5.0 Favored Glycine 0 N--CA 1.473 1.154 0 O-C-N 121.03 -1.044 . . . . 0.0 111.234 -170.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG23 ' A' ' 2' ' ' THR . 9.8 t80 62.43 -64.49 0.09 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.668 1.587 . . . . 0.0 114.028 -177.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -87.04 14.72 6.99 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.706 -1.246 . . . . 0.0 112.017 -178.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 49.2 tpp -154.73 152.16 29.57 Favored 'General case' 0 C--O 1.283 2.831 0 O-C-N 121.617 -0.677 . . . . 0.0 111.052 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 21.3 t -106.3 -53.81 2.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 176.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -144.33 160.68 47.74 Favored Pre-proline 0 C--O 1.215 -0.753 0 N-CA-C 105.257 -2.127 . . . . 0.0 105.257 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.64 150.9 96.33 Favored 'Cis proline' 0 C--N 1.372 1.805 0 O-C-N 123.147 1.077 . . . . 0.0 111.075 -5.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -136.72 -69.17 0.47 Allowed 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.415 1.072 . . . . 0.0 111.187 -179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.394 0 O-C-N 121.107 -0.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.508 2.451 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.7 p -73.03 159.82 33.04 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -137.93 -19.31 1.16 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -179.212 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.7 t -147.32 149.84 33.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.11 -149.23 31.34 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -75.54 -39.74 57.88 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 123.075 1.417 . . . . 0.0 112.573 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.27 15.11 1.14 Allowed 'General case' 0 C--O 1.211 -0.967 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.3 mmt -81.77 -176.87 6.31 Favored 'General case' 0 C--O 1.242 0.686 0 O-C-N 120.592 -1.318 . . . . 0.0 107.82 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 15.9 t -150.62 179.65 8.0 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.0 m -68.45 145.65 97.37 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 119.046 0.839 . . . . 0.0 112.416 -173.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -66.21 143.32 61.85 Favored 'Cis proline' 0 CA--C 1.536 0.614 0 C-N-CA 131.759 1.983 . . . . 0.0 110.793 2.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.22 137.72 54.81 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -173.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.096 0 O-C-N 119.056 -2.277 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -81.55 157.5 24.77 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 8' ' ' MET . 9.3 t -158.03 -154.95 0.47 Allowed 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.68 150.86 39.86 Favored 'General case' 0 C--O 1.261 1.666 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 173.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 66.49 -145.49 47.31 Favored Glycine 0 C--O 1.211 -1.301 0 N-CA-C 105.035 -3.226 . . . . 0.0 105.035 -172.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -79.18 -44.96 20.87 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 164.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.15 134.5 14.27 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.495 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 17.4 ttt -166.05 44.51 0.07 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -88.16 73.92 8.89 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 122.555 1.169 . . . . 0.0 112.191 -175.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -77.86 -11.06 0.17 Allowed Pre-proline 0 CA--C 1.581 2.166 0 N-CA-C 119.451 3.13 . . . . 0.0 119.451 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.37 150.04 87.36 Favored 'Cis proline' 0 N--CA 1.488 1.198 1 C-N-CA 137.469 4.362 . . . . 0.0 115.649 2.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.1 t -79.26 125.62 29.71 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.237 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.396 0 O-C-N 122.318 -0.239 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.19 -2.075 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.8 p -71.88 146.24 48.02 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.791 0.723 . . . . 0.0 110.081 -175.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 14.1 m -126.83 -130.04 0.23 Allowed 'General case' 0 CA--C 1.565 1.552 0 O-C-N 123.869 0.731 . . . . 0.0 110.777 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.9 p -58.97 123.49 16.74 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.64 12.95 74.46 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 120.932 -1.105 . . . . 0.0 115.182 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 64.1 142.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.74 1.216 . . . . 0.0 113.518 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.32 -44.87 0.07 Allowed 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 127.912 2.485 . . . . 0.0 115.888 -174.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 60.3 ttp -68.27 152.24 45.74 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.81 1.644 . . . . 0.0 108.578 175.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 10.7 t -156.14 -51.9 0.08 Allowed 'General case' 0 C--O 1.207 -1.169 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.3 t -139.33 111.95 7.85 Favored Pre-proline 0 N--CA 1.484 1.243 0 CA-C-O 116.853 -1.546 . . . . 0.0 108.96 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.91 163.7 90.04 Favored 'Cis proline' 0 CA--C 1.553 1.436 0 O-C-N 124.744 1.918 . . . . 0.0 115.091 -5.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.5 m -92.19 115.62 28.23 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 172.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.044 0 CA-C-N 116.103 -0.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.513 2.705 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -139.9 148.76 42.49 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.5 m -144.33 -32.3 0.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 O-C-N 124.743 1.277 . . . . 0.0 111.832 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.4 m -118.88 123.45 44.72 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.05 -1.031 . . . . 0.0 111.346 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA3' HH21 ' A' ' 7' ' ' ARG . . . 61.23 22.62 61.07 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-O 120.117 -0.268 . . . . 0.0 113.612 178.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 58.38 2.69 0.22 Allowed 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.522 HH21 ' HA3' ' A' ' 5' ' ' GLY . 0.1 OUTLIER -119.39 -6.96 10.27 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -177.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -156.98 167.98 28.85 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.906 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.6 t -127.15 -55.8 1.35 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 120.169 1.35 . . . . 0.0 110.659 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.1 p -145.94 136.28 12.09 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.338 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -65.11 153.08 77.16 Favored 'Cis proline' 0 C--N 1.367 1.513 0 C-N-CA 130.965 1.652 . . . . 0.0 113.019 -5.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.9 t . . . . . 0 C--O 1.211 -0.964 0 O-C-N 124.787 1.304 . . . . 0.0 109.454 178.82 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -131.23 146.87 52.49 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.652 0.66 . . . . 0.0 109.45 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.9 p -153.21 -3.71 0.21 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 123.943 1.83 . . . . 0.0 113.642 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.6 t -125.56 75.54 1.49 Allowed 'General case' 0 C--O 1.255 1.393 0 N-CA-C 104.412 -2.44 . . . . 0.0 104.412 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.78 -172.37 51.79 Favored Glycine 0 C--O 1.272 2.513 0 N-CA-C 103.908 -3.677 . . . . 0.0 103.908 -173.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.95 14.78 22.44 Favored 'General case' 0 C--O 1.195 -1.781 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.263 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.76 -24.15 8.84 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -154.48 -177.9 6.79 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.318 1.011 . . . . 0.0 109.335 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.6 t -134.8 -136.57 0.16 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.2 m -61.15 154.52 61.27 Favored Pre-proline 0 CA--C 1.543 0.694 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.53 -13.82 17.57 Favored 'Cis proline' 0 C--N 1.364 1.385 0 C-N-CA 131.608 1.92 . . . . 0.0 114.685 1.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.478 0.953 0 O-C-N 124.383 1.052 . . . . 0.0 112.309 -175.591 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.21 -1.005 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.1 p -105.61 161.16 14.61 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.1 m -135.06 -30.95 1.02 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -173.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 23.9 p -148.63 158.6 44.25 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.373 -0.829 . . . . 0.0 110.85 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.44 23.62 62.76 Favored Glycine 0 C--O 1.225 -0.41 0 C-N-CA 120.047 -1.073 . . . . 0.0 113.787 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.2 p90 53.76 -21.02 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 118.253 2.686 . . . . 0.0 118.253 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.08 17.38 5.59 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.0 tpp -143.64 154.42 43.52 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.565 -0.709 . . . . 0.0 110.661 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.9 t -130.98 -47.59 1.02 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.116 170.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.4 125.12 18.54 Favored Pre-proline 0 CA--C 1.563 1.464 0 O-C-N 124.199 0.937 . . . . 0.0 110.642 -178.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.68 168.6 76.69 Favored 'Cis proline' 0 C--N 1.368 1.589 0 C-N-CA 129.384 0.993 . . . . 0.0 110.718 -4.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.9 t . . . . . 0 C--N 1.328 -0.366 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -177.767 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.496 1.846 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -137.51 156.7 47.83 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.428 1.013 . . . . 0.0 111.197 -173.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.7 p -158.1 -21.72 0.08 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 69.4 m -112.92 35.02 4.08 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -175.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.31 -172.4 23.84 Favored Glycine 0 C--N 1.315 -0.62 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -65.15 -30.74 71.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.95 -7.53 3.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 117.182 2.289 . . . . 0.0 117.182 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.3 ptp -119.54 156.45 30.28 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.883 -1.136 . . . . 0.0 112.481 -172.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 t -157.81 90.83 1.09 Allowed 'General case' 0 C--O 1.211 -0.93 0 C-N-CA 124.156 0.982 . . . . 0.0 110.829 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 62.77 102.86 0.03 OUTLIER Pre-proline 0 C--O 1.208 -1.09 0 C-N-CA 125.027 1.331 . . . . 0.0 113.129 -175.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.36 155.72 43.21 Favored 'Cis proline' 0 C--N 1.356 0.945 0 N-CA-C 115.681 1.377 . . . . 0.0 115.681 -0.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 C--N 1.312 -1.047 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.68 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.214 -0.812 0 CA-C-O 119.213 -0.423 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.7 t -146.49 155.33 42.45 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.593 1.088 . . . . 0.0 110.954 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -142.58 -6.23 0.91 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.0 m -134.25 106.56 7.2 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.57 -152.62 41.39 Favored Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 107.524 -2.23 . . . . 0.0 107.524 -177.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -113.93 19.69 16.35 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 117.781 0.79 . . . . 0.0 112.881 -175.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.72 -3.71 0.1 Allowed 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -175.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 ttm -133.01 152.18 51.99 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -171.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.4 t -154.77 136.1 14.08 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.4 t 24.94 104.45 0.01 OUTLIER Pre-proline 0 CA--C 1.562 1.435 0 N-CA-C 119.541 3.163 . . . . 0.0 119.541 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.48 156.05 89.76 Favored 'Cis proline' 0 C--N 1.36 1.164 0 C-N-CA 133.431 2.68 . . . . 0.0 114.238 3.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 104.767 -2.308 . . . . 0.0 104.767 177.883 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -72.46 128.83 36.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.2 t -158.9 -175.28 5.2 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -50.26 141.42 11.57 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 122.03 0.919 . . . . 0.0 112.002 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.76 38.94 96.77 Favored Glycine 0 C--O 1.197 -2.16 0 C-N-CA 120.074 -1.06 . . . . 0.0 111.085 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 60.92 -51.46 0.1 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 127.75 2.42 . . . . 0.0 116.062 -177.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.91 -13.22 1.24 Allowed 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.443 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.9 ptp -73.5 -30.21 62.98 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.335 1.425 . . . . 0.0 113.812 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 t 63.16 -60.16 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 N-CA-C 117.33 2.345 . . . . 0.0 117.33 174.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.35 129.93 9.67 Favored Pre-proline 0 C--O 1.205 -1.261 0 CA-C-N 119.758 1.163 . . . . 0.0 110.233 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -69.88 151.83 92.09 Favored 'Cis proline' 0 C--N 1.355 0.892 0 C-N-CA 129.822 1.176 . . . . 0.0 113.856 -4.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t . . . . . 0 C--O 1.217 -0.638 0 C-N-CA 125.042 1.337 . . . . 0.0 110.808 -178.7 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.782 0.325 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.7 p -80.43 157.54 26.21 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.065 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -138.62 -15.89 1.18 Allowed 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.9 t -136.61 112.34 9.46 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.99 -150.63 47.92 Favored Glycine 0 C--O 1.187 -2.806 0 N-CA-C 104.708 -3.357 . . . . 0.0 104.708 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -122.59 21.91 10.0 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.132 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 2.23 3.44 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -178.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.3 ptm -158.94 161.58 36.76 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.4 t -147.41 99.75 3.17 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.529 ' H ' ' HA ' ' A' ' 11' ' ' PRO . 57.7 t -121.02 -50.89 0.04 OUTLIER Pre-proline 0 C--N 1.318 -0.803 0 O-C-N 123.508 0.505 . . . . 0.0 111.833 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.529 ' HA ' ' H ' ' A' ' 10' ' ' VAL . 26.5 Cg_endo -88.14 171.83 32.51 Favored 'Cis proline' 0 CA--C 1.565 2.057 1 C-N-CA 138.464 4.777 . . . . 0.0 111.533 -2.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.2 m . . . . . 0 C--O 1.19 -2.075 0 C-N-CA 123.752 0.821 . . . . 0.0 110.638 -179.83 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.3 p -129.57 169.14 15.39 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -147.45 10.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.6 t -146.36 62.05 1.22 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.04 171.07 47.33 Favored Glycine 0 C--O 1.204 -1.726 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.766 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -57.25 -26.66 61.13 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 117.622 0.711 . . . . 0.0 112.541 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 -6.9 20.47 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 -173.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.17 168.84 21.4 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.94 150.44 36.99 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.73 141.11 97.16 Favored Pre-proline 0 C--O 1.218 -0.584 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -66.09 126.48 6.89 Favored 'Cis proline' 0 C--O 1.202 -1.299 0 C-N-CA 132.736 2.39 . . . . 0.0 110.756 -2.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 C--O 1.217 -0.624 0 CA-C-N 113.286 -1.779 . . . . 0.0 110.895 -178.485 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.59 143.64 44.22 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 103.763 -2.68 . . . . 0.0 103.763 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.4 p -142.13 -7.98 0.91 Allowed 'General case' 0 C--O 1.246 0.897 0 O-C-N 125.283 1.614 . . . . 0.0 114.367 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.0 m -122.78 86.07 2.52 Favored 'General case' 0 C--O 1.211 -0.929 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.71 -164.42 53.1 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 106.986 -2.446 . . . . 0.0 106.986 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -102.02 25.73 8.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.009 -0.7 . . . . 0.0 109.12 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.86 -8.8 1.84 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.3 ttp -150.36 166.91 28.61 Favored 'General case' 0 C--O 1.272 2.238 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.125 -175.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.2 t -163.42 -42.42 0.03 OUTLIER 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.501 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.0 t -128.64 120.84 20.87 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.981 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -84.98 166.13 57.53 Favored 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 129.899 1.208 . . . . 0.0 111.323 -10.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 173.661 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.0 t -139.65 143.51 37.2 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 104.707 -2.331 . . . . 0.0 104.707 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.7 p -163.94 -34.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.116 1.51 . . . . 0.0 114.6 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.3 p -95.3 -14.85 23.59 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.38 61.36 0.1 Allowed Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 118.878 2.311 . . . . 0.0 118.878 -175.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 83.1 t80 62.97 -47.88 0.2 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.433 ' H ' ' HD3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -122.58 7.57 9.49 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -179.851 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.0 mtt -143.98 156.95 44.6 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.0 t -142.77 -178.93 6.04 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 102.323 -3.214 . . . . 0.0 102.323 176.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.18 131.36 60.37 Favored Pre-proline 0 CA--C 1.573 1.849 0 CA-C-N 119.491 1.041 . . . . 0.0 112.238 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -67.34 132.11 17.54 Favored 'Cis proline' 0 C--N 1.381 2.264 0 C-N-CA 131.19 1.746 . . . . 0.0 114.502 -0.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 N--CA 1.488 1.467 0 O-C-N 120.766 -1.209 . . . . 0.0 110.516 -176.179 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.2 t -145.21 146.15 31.61 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.0 p -154.67 -6.24 0.14 Allowed 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.557 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 25.3 p -152.18 155.25 37.43 Favored 'General case' 0 C--O 1.293 3.37 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.682 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.52 21.06 40.56 Favored Glycine 0 CA--C 1.546 1.972 0 C-N-CA 119.464 -1.351 . . . . 0.0 114.929 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.7 t80 65.21 -19.97 0.08 Allowed 'General case' 0 C--O 1.201 -1.457 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.12 25.01 0.91 Allowed 'General case' 0 CA--C 1.56 1.328 0 O-C-N 121.118 -0.989 . . . . 0.0 113.275 -175.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.2 tpp -135.67 154.13 51.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.005 -1.06 . . . . 0.0 109.806 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.7 t -162.8 149.88 13.16 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 m 28.31 85.36 0.13 Allowed Pre-proline 0 N--CA 1.483 1.208 0 N-CA-C 118.357 2.725 . . . . 0.0 118.357 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -87.02 173.84 31.46 Favored 'Cis proline' 0 CA--C 1.486 -1.881 0 C-N-CA 131.376 1.823 . . . . 0.0 111.746 0.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m . . . . . 0 CA--C 1.556 1.183 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 175.885 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.495 1.783 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.8 t -155.24 141.18 18.24 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 117.405 -1.283 . . . . 0.0 108.727 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 p -129.98 -4.65 4.52 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 124.905 1.378 . . . . 0.0 109.079 176.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.6 t -133.05 100.87 5.01 Favored 'General case' 0 C--O 1.263 1.782 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -178.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.24 -153.48 49.58 Favored Glycine 0 C--O 1.21 -1.367 0 C-N-CA 119.529 -1.319 . . . . 0.0 111.656 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -100.61 0.79 39.92 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.52 -10.66 4.04 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -175.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.6 mtp -144.2 -179.56 6.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 120.229 1.377 . . . . 0.0 114.239 -169.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -152.41 -179.4 7.53 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 102.043 -3.317 . . . . 0.0 102.043 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 t -60.4 132.77 90.78 Favored Pre-proline 0 CA--C 1.56 1.328 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.339 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.71 132.16 23.92 Favored 'Cis proline' 0 C--O 1.21 -0.897 0 C-N-CA 130.453 1.439 . . . . 0.0 113.297 6.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.467 0.424 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.293 -178.886 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -138.24 144.74 40.72 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 123.342 1.544 . . . . 0.0 109.919 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 p -159.09 -6.85 0.07 Allowed 'General case' 0 CA--C 1.576 1.957 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.186 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.1 t -122.74 95.34 4.59 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 102.574 -3.121 . . . . 0.0 102.574 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.92 -159.8 53.87 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 107.197 -2.361 . . . . 0.0 107.197 -169.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -114.62 28.43 8.73 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 122.134 -0.627 . . . . 0.0 112.112 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.31 -27.85 2.64 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ptp -154.58 176.07 12.85 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.334 -1.479 . . . . 0.0 111.984 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.3 t -126.46 -176.43 3.67 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.6 t -61.35 134.16 93.27 Favored Pre-proline 0 N--CA 1.482 1.153 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.47 120.33 7.14 Favored 'Cis proline' 0 C--N 1.353 0.767 0 C-N-CA 131.92 2.05 . . . . 0.0 112.049 2.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 C--O 1.214 -0.783 0 CA-C-O 122.576 1.179 . . . . 0.0 112.377 -173.871 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 118.365 -0.826 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.6 m -81.37 136.19 35.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.263 0.938 . . . . 0.0 108.52 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.51 -142.86 0.13 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.544 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.3 m -66.92 137.37 56.5 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.003 -177.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.6 22.57 46.6 Favored Glycine 0 N--CA 1.478 1.495 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 60.45 12.29 3.42 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.16 1.784 . . . . 0.0 113.246 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -140.36 -65.27 0.46 Allowed 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.8 ttp -82.63 143.26 31.1 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -171.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.36 -14.58 6.4 Favored 'General case' 0 C--O 1.206 -1.207 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.513 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -134.29 124.15 17.07 Favored Pre-proline 0 C--N 1.321 -0.661 0 O-C-N 121.817 -0.552 . . . . 0.0 110.693 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -94.86 8.67 49.53 Favored 'Cis proline' 0 C--O 1.254 1.276 0 C-N-CA 133.647 2.77 . . . . 0.0 113.558 -2.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.9 m . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 123.165 1.459 . . . . 0.0 111.351 -176.862 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.192 -1.971 0 CA-C-O 121.07 0.462 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.566 HG23 ' HA ' ' A' ' 6' ' ' TYR . 18.7 m -112.91 118.16 34.11 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 30.5 m -134.6 -54.9 0.84 Allowed 'General case' 0 C--O 1.193 -1.9 0 CA-C-O 122.172 0.987 . . . . 0.0 110.964 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.4 m -126.34 122.7 36.16 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-O 122.154 0.978 . . . . 0.0 111.219 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 50.33 34.4 25.84 Favored Glycine 0 N--CA 1.476 1.305 0 O-C-N 119.775 -1.828 . . . . 0.0 116.092 -178.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.566 ' HA ' HG23 ' A' ' 2' ' ' THR . 86.5 t80 66.83 -53.4 0.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -84.13 -19.03 34.88 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.91 2.559 . . . . 0.0 117.91 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 54.4 ttm -114.62 150.18 35.48 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.408 1.004 . . . . 0.0 109.67 -172.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 19.3 t -148.5 -48.9 0.16 Allowed 'General case' 0 C--O 1.248 0.991 0 CA-C-O 117.631 -1.176 . . . . 0.0 113.279 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -136.74 114.11 10.13 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -65.1 151.71 76.47 Favored 'Cis proline' 0 C--N 1.374 1.913 0 C-N-CA 129.722 1.134 . . . . 0.0 112.813 -5.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.5 t . . . . . 0 C--N 1.302 -1.49 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.396 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 C--O 1.184 -2.385 0 CA-C-O 120.901 0.381 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.9 p -131.18 179.14 6.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.08 -49.01 0.42 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.35 -44.49 75.14 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 119.293 0.951 . . . . 0.0 113.318 -171.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.52 42.43 0.68 Allowed Glycine 0 C--N 1.31 -0.913 0 N-CA-C 115.387 0.915 . . . . 0.0 115.387 -176.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 61.14 -13.67 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -131.7 12.5 4.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.712 0.768 . . . . 0.0 111.575 176.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.8 ttm -152.49 142.45 22.16 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.409 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.1 t -164.27 145.13 8.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 t 35.96 90.47 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -83.19 178.31 28.84 Favored 'Cis proline' 0 CA--C 1.498 -1.297 0 C-N-CA 132.302 2.209 . . . . 0.0 108.755 -4.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.436 -1.144 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.693 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.3 t . . . . . 0 N--CA 1.501 2.081 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.503 HG23 ' HA ' ' A' ' 6' ' ' TYR . 97.7 m -83.42 117.69 23.22 Favored 'General case' 0 C--O 1.2 -1.501 0 O-C-N 121.375 -0.828 . . . . 0.0 110.23 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -138.97 -46.31 0.48 Allowed 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 174.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.81 -60.84 1.76 Allowed 'General case' 0 C--O 1.188 -2.173 0 CA-C-O 122.056 0.931 . . . . 0.0 111.46 -173.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.16 35.41 5.0 Favored Glycine 0 N--CA 1.473 1.154 0 O-C-N 121.03 -1.044 . . . . 0.0 111.234 -170.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG23 ' A' ' 2' ' ' THR . 9.8 t80 62.43 -64.49 0.09 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.668 1.587 . . . . 0.0 114.028 -177.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -87.04 14.72 6.99 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.706 -1.246 . . . . 0.0 112.017 -178.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 49.2 tpp -154.73 152.16 29.57 Favored 'General case' 0 C--O 1.283 2.831 0 O-C-N 121.617 -0.677 . . . . 0.0 111.052 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 21.3 t -106.3 -53.81 2.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 176.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -144.33 160.68 47.74 Favored Pre-proline 0 C--O 1.215 -0.753 0 N-CA-C 105.257 -2.127 . . . . 0.0 105.257 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.64 150.9 96.33 Favored 'Cis proline' 0 C--N 1.372 1.805 0 O-C-N 123.147 1.077 . . . . 0.0 111.075 -5.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.215 -0.712 0 O-C-N 124.415 1.072 . . . . 0.0 111.187 -179.198 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.508 2.451 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.7 p -73.03 159.82 33.04 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -137.93 -19.31 1.16 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -179.212 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.7 t -147.32 149.84 33.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.11 -149.23 31.34 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -75.54 -39.74 57.88 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 123.075 1.417 . . . . 0.0 112.573 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.27 15.11 1.14 Allowed 'General case' 0 C--O 1.211 -0.967 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.3 mmt -81.77 -176.87 6.31 Favored 'General case' 0 C--O 1.242 0.686 0 O-C-N 120.592 -1.318 . . . . 0.0 107.82 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 15.9 t -150.62 179.65 8.0 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.0 m -68.45 145.65 97.37 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 119.046 0.839 . . . . 0.0 112.416 -173.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -66.21 143.32 61.85 Favored 'Cis proline' 0 CA--C 1.536 0.614 0 C-N-CA 131.759 1.983 . . . . 0.0 110.793 2.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -173.392 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -81.55 157.5 24.77 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 8' ' ' MET . 9.3 t -158.03 -154.95 0.47 Allowed 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.68 150.86 39.86 Favored 'General case' 0 C--O 1.261 1.666 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 173.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 66.49 -145.49 47.31 Favored Glycine 0 C--O 1.211 -1.301 0 N-CA-C 105.035 -3.226 . . . . 0.0 105.035 -172.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -79.18 -44.96 20.87 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 164.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.15 134.5 14.27 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.495 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 17.4 ttt -166.05 44.51 0.07 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -88.16 73.92 8.89 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 122.555 1.169 . . . . 0.0 112.191 -175.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -77.86 -11.06 0.17 Allowed Pre-proline 0 CA--C 1.581 2.166 0 N-CA-C 119.451 3.13 . . . . 0.0 119.451 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.37 150.04 87.36 Favored 'Cis proline' 0 N--CA 1.488 1.198 1 C-N-CA 137.469 4.362 . . . . 0.0 115.649 2.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.473 0.71 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.237 177.667 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.19 -2.075 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.8 p -71.88 146.24 48.02 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.791 0.723 . . . . 0.0 110.081 -175.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 14.1 m -126.83 -130.04 0.23 Allowed 'General case' 0 CA--C 1.565 1.552 0 O-C-N 123.869 0.731 . . . . 0.0 110.777 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.9 p -58.97 123.49 16.74 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.64 12.95 74.46 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 120.932 -1.105 . . . . 0.0 115.182 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 64.1 142.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.74 1.216 . . . . 0.0 113.518 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.32 -44.87 0.07 Allowed 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 127.912 2.485 . . . . 0.0 115.888 -174.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 60.3 ttp -68.27 152.24 45.74 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.81 1.644 . . . . 0.0 108.578 175.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 10.7 t -156.14 -51.9 0.08 Allowed 'General case' 0 C--O 1.207 -1.169 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.3 t -139.33 111.95 7.85 Favored Pre-proline 0 N--CA 1.484 1.243 0 CA-C-O 116.853 -1.546 . . . . 0.0 108.96 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.91 163.7 90.04 Favored 'Cis proline' 0 CA--C 1.553 1.436 0 O-C-N 124.744 1.918 . . . . 0.0 115.091 -5.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.5 m . . . . . 0 C--O 1.211 -0.957 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 172.434 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.513 2.705 0 CA-C-O 119.023 -0.513 . . . . 0.0 110.061 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.4 t -139.9 148.76 42.49 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.5 m -144.33 -32.3 0.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 O-C-N 124.743 1.277 . . . . 0.0 111.832 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.4 m -118.88 123.45 44.72 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.05 -1.031 . . . . 0.0 111.346 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' HA3' HH21 ' A' ' 7' ' ' ARG . . . 61.23 22.62 61.07 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-O 120.117 -0.268 . . . . 0.0 113.612 178.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 58.38 2.69 0.22 Allowed 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.522 HH21 ' HA3' ' A' ' 5' ' ' GLY . 0.1 OUTLIER -119.39 -6.96 10.27 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -177.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -156.98 167.98 28.85 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.906 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.6 t -127.15 -55.8 1.35 Allowed 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 120.169 1.35 . . . . 0.0 110.659 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.1 p -145.94 136.28 12.09 Favored Pre-proline 0 N--CA 1.447 -0.583 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.338 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -65.11 153.08 77.16 Favored 'Cis proline' 0 C--N 1.367 1.513 0 C-N-CA 130.965 1.652 . . . . 0.0 113.019 -5.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 52.9 t -143.01 130.11 20.75 Favored 'General case' 0 C--O 1.211 -0.964 0 O-C-N 124.787 1.304 . . . . 0.0 109.454 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.679 0 O-C-N 121.226 -0.921 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.7 p -131.23 146.87 52.49 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.652 0.66 . . . . 0.0 109.45 -177.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.9 p -153.21 -3.71 0.21 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 123.943 1.83 . . . . 0.0 113.642 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.6 t -125.56 75.54 1.49 Allowed 'General case' 0 C--O 1.255 1.393 0 N-CA-C 104.412 -2.44 . . . . 0.0 104.412 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.78 -172.37 51.79 Favored Glycine 0 C--O 1.272 2.513 0 N-CA-C 103.908 -3.677 . . . . 0.0 103.908 -173.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.95 14.78 22.44 Favored 'General case' 0 C--O 1.195 -1.781 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.263 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.76 -24.15 8.84 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -154.48 -177.9 6.79 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.318 1.011 . . . . 0.0 109.335 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.6 t -134.8 -136.57 0.16 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.2 m -61.15 154.52 61.27 Favored Pre-proline 0 CA--C 1.543 0.694 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.53 -13.82 17.57 Favored 'Cis proline' 0 C--N 1.364 1.385 0 C-N-CA 131.608 1.92 . . . . 0.0 114.685 1.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.1 t 53.5 56.51 7.22 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 124.383 1.052 . . . . 0.0 112.309 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.05 0 O-C-N 119.392 -2.067 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.21 -1.005 0 CA-C-O 117.886 -1.054 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 50.1 p -105.61 161.16 14.61 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.1 m -135.06 -30.95 1.02 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -173.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 23.9 p -148.63 158.6 44.25 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.373 -0.829 . . . . 0.0 110.85 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.44 23.62 62.76 Favored Glycine 0 C--O 1.225 -0.41 0 C-N-CA 120.047 -1.073 . . . . 0.0 113.787 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.2 p90 53.76 -21.02 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 118.253 2.686 . . . . 0.0 118.253 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.08 17.38 5.59 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.0 tpp -143.64 154.42 43.52 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.565 -0.709 . . . . 0.0 110.661 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.9 t -130.98 -47.59 1.02 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-O 118.371 -0.823 . . . . 0.0 110.116 170.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.4 125.12 18.54 Favored Pre-proline 0 CA--C 1.563 1.464 0 O-C-N 124.199 0.937 . . . . 0.0 110.642 -178.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.68 168.6 76.69 Favored 'Cis proline' 0 C--N 1.368 1.589 0 C-N-CA 129.384 0.993 . . . . 0.0 110.718 -4.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.9 t -136.86 127.87 27.66 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.595 0 O-C-N 121.144 -0.972 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.496 1.846 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -137.51 156.7 47.83 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.428 1.013 . . . . 0.0 111.197 -173.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.7 p -158.1 -21.72 0.08 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.286 1.587 . . . . 0.0 115.286 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 69.4 m -112.92 35.02 4.08 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -175.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.31 -172.4 23.84 Favored Glycine 0 C--N 1.315 -0.62 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -65.15 -30.74 71.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.95 -7.53 3.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 117.182 2.289 . . . . 0.0 117.182 -174.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.3 ptp -119.54 156.45 30.28 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.883 -1.136 . . . . 0.0 112.481 -172.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 t -157.81 90.83 1.09 Allowed 'General case' 0 C--O 1.211 -0.93 0 C-N-CA 124.156 0.982 . . . . 0.0 110.829 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 62.77 102.86 0.03 OUTLIER Pre-proline 0 C--O 1.208 -1.09 0 C-N-CA 125.027 1.331 . . . . 0.0 113.129 -175.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.36 155.72 43.21 Favored 'Cis proline' 0 C--N 1.356 0.945 0 N-CA-C 115.681 1.377 . . . . 0.0 115.681 -0.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.5 m -127.09 131.0 50.95 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 -179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.68 0 O-C-N 124.009 0.818 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.214 -0.812 0 CA-C-O 119.213 -0.423 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.7 t -146.49 155.33 42.45 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.593 1.088 . . . . 0.0 110.954 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -142.58 -6.23 0.91 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 45.0 m -134.25 106.56 7.2 Favored 'General case' 0 C--O 1.253 1.256 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.57 -152.62 41.39 Favored Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 107.524 -2.23 . . . . 0.0 107.524 -177.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -113.93 19.69 16.35 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 117.781 0.79 . . . . 0.0 112.881 -175.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.72 -3.71 0.1 Allowed 'General case' 0 CA--C 1.561 1.396 0 N-CA-C 117.037 2.236 . . . . 0.0 117.037 -175.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 ttm -133.01 152.18 51.99 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -171.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.4 t -154.77 136.1 14.08 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.4 t 24.94 104.45 0.01 OUTLIER Pre-proline 0 CA--C 1.562 1.435 0 N-CA-C 119.541 3.163 . . . . 0.0 119.541 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.48 156.05 89.76 Favored 'Cis proline' 0 C--N 1.36 1.164 0 C-N-CA 133.431 2.68 . . . . 0.0 114.238 3.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.2 p -172.02 165.66 6.25 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 104.767 -2.308 . . . . 0.0 104.767 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.373 1.624 0 O-C-N 119.574 -1.953 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.1 m -72.46 128.83 36.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.2 t -158.9 -175.28 5.2 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -50.26 141.42 11.57 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 122.03 0.919 . . . . 0.0 112.002 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 61.76 38.94 96.77 Favored Glycine 0 C--O 1.197 -2.16 0 C-N-CA 120.074 -1.06 . . . . 0.0 111.085 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 60.92 -51.46 0.1 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 127.75 2.42 . . . . 0.0 116.062 -177.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.91 -13.22 1.24 Allowed 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 117.611 -1.185 . . . . 0.0 113.443 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.9 ptp -73.5 -30.21 62.98 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.335 1.425 . . . . 0.0 113.812 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 t 63.16 -60.16 0.15 Allowed 'General case' 0 CA--C 1.556 1.188 0 N-CA-C 117.33 2.345 . . . . 0.0 117.33 174.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.35 129.93 9.67 Favored Pre-proline 0 C--O 1.205 -1.261 0 CA-C-N 119.758 1.163 . . . . 0.0 110.233 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -69.88 151.83 92.09 Favored 'Cis proline' 0 C--N 1.355 0.892 0 C-N-CA 129.822 1.176 . . . . 0.0 113.856 -4.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -104.17 114.67 29.07 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 125.042 1.337 . . . . 0.0 110.808 -178.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.841 0 O-C-N 121.268 -0.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.782 0.325 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.7 p -80.43 157.54 26.21 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.065 -177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -138.62 -15.89 1.18 Allowed 'General case' 0 C--O 1.215 -0.76 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.9 t -136.61 112.34 9.46 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.99 -150.63 47.92 Favored Glycine 0 C--O 1.187 -2.806 0 N-CA-C 104.708 -3.357 . . . . 0.0 104.708 -175.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -122.59 21.91 10.0 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.132 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 2.23 3.44 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -178.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.3 ptm -158.94 161.58 36.76 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 47.4 t -147.41 99.75 3.17 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.529 ' H ' ' HA ' ' A' ' 11' ' ' PRO . 57.7 t -121.02 -50.89 0.04 OUTLIER Pre-proline 0 C--N 1.318 -0.803 0 O-C-N 123.508 0.505 . . . . 0.0 111.833 -178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.529 ' HA ' ' H ' ' A' ' 10' ' ' VAL . 26.5 Cg_endo -88.14 171.83 32.51 Favored 'Cis proline' 0 CA--C 1.565 2.057 1 C-N-CA 138.464 4.777 . . . . 0.0 111.533 -2.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 84.2 m -68.2 156.12 38.24 Favored 'General case' 0 C--O 1.19 -2.075 0 C-N-CA 123.752 0.821 . . . . 0.0 110.638 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.101 0 O-C-N 121.856 -0.527 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.3 p -129.57 169.14 15.39 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.5 p -147.45 10.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.6 t -146.36 62.05 1.22 Allowed 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.04 171.07 47.33 Favored Glycine 0 C--O 1.204 -1.726 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.766 -178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -57.25 -26.66 61.13 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 117.622 0.711 . . . . 0.0 112.541 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 -6.9 20.47 Favored 'General case' 0 C--O 1.207 -1.134 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 -173.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.17 168.84 21.4 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 42.7 t -144.94 150.44 36.99 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 174.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.73 141.11 97.16 Favored Pre-proline 0 C--O 1.218 -0.584 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -173.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -66.09 126.48 6.89 Favored 'Cis proline' 0 C--O 1.202 -1.299 0 C-N-CA 132.736 2.39 . . . . 0.0 110.756 -2.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 24.7 p -138.36 14.1 2.79 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 113.286 -1.779 . . . . 0.0 110.895 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 0.376 0 O-C-N 119.803 -1.811 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.59 143.64 44.22 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 103.763 -2.68 . . . . 0.0 103.763 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 24.4 p -142.13 -7.98 0.91 Allowed 'General case' 0 C--O 1.246 0.897 0 O-C-N 125.283 1.614 . . . . 0.0 114.367 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.0 m -122.78 86.07 2.52 Favored 'General case' 0 C--O 1.211 -0.929 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.71 -164.42 53.1 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 106.986 -2.446 . . . . 0.0 106.986 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -102.02 25.73 8.4 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.009 -0.7 . . . . 0.0 109.12 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.86 -8.8 1.84 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -178.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.3 ttp -150.36 166.91 28.61 Favored 'General case' 0 C--O 1.272 2.238 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.125 -175.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.2 t -163.42 -42.42 0.03 OUTLIER 'General case' 0 C--N 1.349 0.556 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.501 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.0 t -128.64 120.84 20.87 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.981 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -84.98 166.13 57.53 Favored 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 129.899 1.208 . . . . 0.0 111.323 -10.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -139.14 156.0 47.45 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 173.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 O-C-N 121.025 -1.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 119.084 -0.484 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.0 t -139.65 143.51 37.2 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 104.707 -2.331 . . . . 0.0 104.707 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.7 p -163.94 -34.22 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 125.116 1.51 . . . . 0.0 114.6 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 18.3 p -95.3 -14.85 23.59 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.38 61.36 0.1 Allowed Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 118.878 2.311 . . . . 0.0 118.878 -175.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 83.1 t80 62.97 -47.88 0.2 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 116.691 2.108 . . . . 0.0 116.691 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.433 ' H ' ' HD3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -122.58 7.57 9.49 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -179.851 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.0 mtt -143.98 156.95 44.6 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 14.0 t -142.77 -178.93 6.04 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 102.323 -3.214 . . . . 0.0 102.323 176.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.18 131.36 60.37 Favored Pre-proline 0 CA--C 1.573 1.849 0 CA-C-N 119.491 1.041 . . . . 0.0 112.238 -178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -67.34 132.11 17.54 Favored 'Cis proline' 0 C--N 1.381 2.264 0 C-N-CA 131.19 1.746 . . . . 0.0 114.502 -0.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.2 t -114.63 144.41 43.45 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.766 -1.209 . . . . 0.0 110.516 -176.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.776 0 O-C-N 121.534 -0.728 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.7 t . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.2 t -145.21 146.15 31.61 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.0 p -154.67 -6.24 0.14 Allowed 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.557 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 25.3 p -152.18 155.25 37.43 Favored 'General case' 0 C--O 1.293 3.37 0 CA-C-O 118.575 -0.726 . . . . 0.0 110.682 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.52 21.06 40.56 Favored Glycine 0 CA--C 1.546 1.972 0 C-N-CA 119.464 -1.351 . . . . 0.0 114.929 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 9.7 t80 65.21 -19.97 0.08 Allowed 'General case' 0 C--O 1.201 -1.457 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -149.12 25.01 0.91 Allowed 'General case' 0 CA--C 1.56 1.328 0 O-C-N 121.118 -0.989 . . . . 0.0 113.275 -175.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.2 tpp -135.67 154.13 51.39 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.005 -1.06 . . . . 0.0 109.806 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.7 t -162.8 149.88 13.16 Favored 'General case' 0 C--O 1.198 -1.653 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 172.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 m 28.31 85.36 0.13 Allowed Pre-proline 0 N--CA 1.483 1.208 0 N-CA-C 118.357 2.725 . . . . 0.0 118.357 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -87.02 173.84 31.46 Favored 'Cis proline' 0 CA--C 1.486 -1.881 0 C-N-CA 131.376 1.823 . . . . 0.0 111.746 0.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -110.04 169.37 8.77 Favored 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 175.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.284 0 O-C-N 121.538 -0.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.495 1.783 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.8 t -155.24 141.18 18.24 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 117.405 -1.283 . . . . 0.0 108.727 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.7 p -129.98 -4.65 4.52 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 124.905 1.378 . . . . 0.0 109.079 176.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.6 t -133.05 100.87 5.01 Favored 'General case' 0 C--O 1.263 1.782 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -178.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.24 -153.48 49.58 Favored Glycine 0 C--O 1.21 -1.367 0 C-N-CA 119.529 -1.319 . . . . 0.0 111.656 -176.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -100.61 0.79 39.92 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.52 -10.66 4.04 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.954 2.946 . . . . 0.0 118.954 -175.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.6 mtp -144.2 -179.56 6.59 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 120.229 1.377 . . . . 0.0 114.239 -169.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -152.41 -179.4 7.53 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 102.043 -3.317 . . . . 0.0 102.043 175.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.9 t -60.4 132.77 90.78 Favored Pre-proline 0 CA--C 1.56 1.328 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.339 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -71.71 132.16 23.92 Favored 'Cis proline' 0 C--O 1.21 -0.897 0 C-N-CA 130.453 1.439 . . . . 0.0 113.297 6.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.04 147.18 27.51 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.293 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 116.757 -0.201 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.9 t -138.24 144.74 40.72 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 123.342 1.544 . . . . 0.0 109.919 176.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 p -159.09 -6.85 0.07 Allowed 'General case' 0 CA--C 1.576 1.957 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.186 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 43.1 t -122.74 95.34 4.59 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 102.574 -3.121 . . . . 0.0 102.574 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.92 -159.8 53.87 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 107.197 -2.361 . . . . 0.0 107.197 -169.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -114.62 28.43 8.73 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 122.134 -0.627 . . . . 0.0 112.112 -177.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.31 -27.85 2.64 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.1 ptp -154.58 176.07 12.85 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.334 -1.479 . . . . 0.0 111.984 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.3 t -126.46 -176.43 3.67 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.6 t -61.35 134.16 93.27 Favored Pre-proline 0 N--CA 1.482 1.153 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.47 120.33 7.14 Favored 'Cis proline' 0 C--N 1.353 0.767 0 C-N-CA 131.92 2.05 . . . . 0.0 112.049 2.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.5 t -95.77 128.53 42.72 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-O 122.576 1.179 . . . . 0.0 112.377 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 O-C-N 120.373 -1.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 118.365 -0.826 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.6 m -81.37 136.19 35.71 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.263 0.938 . . . . 0.0 108.52 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.3 t -149.51 -142.86 0.13 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.544 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.3 m -66.92 137.37 56.5 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.003 -177.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.6 22.57 46.6 Favored Glycine 0 N--CA 1.478 1.495 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 60.45 12.29 3.42 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.16 1.784 . . . . 0.0 113.246 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -140.36 -65.27 0.46 Allowed 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 51.8 ttp -82.63 143.26 31.1 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -171.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.36 -14.58 6.4 Favored 'General case' 0 C--O 1.206 -1.207 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.513 -179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -134.29 124.15 17.07 Favored Pre-proline 0 C--N 1.321 -0.661 0 O-C-N 121.817 -0.552 . . . . 0.0 110.693 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -94.86 8.67 49.53 Favored 'Cis proline' 0 C--O 1.254 1.276 0 C-N-CA 133.647 2.77 . . . . 0.0 113.558 -2.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.9 m 53.69 53.56 11.25 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-O 123.165 1.459 . . . . 0.0 111.351 -176.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.512 0 CA-C-N 114.984 -1.007 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.8 m . . . . . 0 C--O 1.192 -1.971 0 CA-C-O 121.07 0.462 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.566 HG23 ' HA ' ' A' ' 6' ' ' TYR . 18.7 m -112.91 118.16 34.11 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -178.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 30.5 m -134.6 -54.9 0.84 Allowed 'General case' 0 C--O 1.193 -1.9 0 CA-C-O 122.172 0.987 . . . . 0.0 110.964 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.4 m -126.34 122.7 36.16 Favored 'General case' 0 CA--C 1.557 1.235 0 CA-C-O 122.154 0.978 . . . . 0.0 111.219 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 50.33 34.4 25.84 Favored Glycine 0 N--CA 1.476 1.305 0 O-C-N 119.775 -1.828 . . . . 0.0 116.092 -178.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.566 ' HA ' HG23 ' A' ' 2' ' ' THR . 86.5 t80 66.83 -53.4 0.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.092 1.516 . . . . 0.0 115.092 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -84.13 -19.03 34.88 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.91 2.559 . . . . 0.0 117.91 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 54.4 ttm -114.62 150.18 35.48 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.408 1.004 . . . . 0.0 109.67 -172.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 19.3 t -148.5 -48.9 0.16 Allowed 'General case' 0 C--O 1.248 0.991 0 CA-C-O 117.631 -1.176 . . . . 0.0 113.279 -179.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -136.74 114.11 10.13 Favored Pre-proline 0 CA--C 1.556 1.195 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 177.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -65.1 151.71 76.47 Favored 'Cis proline' 0 C--N 1.374 1.913 0 C-N-CA 129.722 1.134 . . . . 0.0 112.813 -5.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.5 t -94.68 102.55 14.46 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.022 0 O-C-N 121.042 -1.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 C--O 1.184 -2.385 0 CA-C-O 120.901 0.381 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.9 p -131.18 179.14 6.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.08 -49.01 0.42 Allowed 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.2 t -68.35 -44.49 75.14 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 119.293 0.951 . . . . 0.0 113.318 -171.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -152.52 42.43 0.68 Allowed Glycine 0 C--N 1.31 -0.913 0 N-CA-C 115.387 0.915 . . . . 0.0 115.387 -176.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 61.14 -13.67 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.1 ppt_? -131.7 12.5 4.87 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.712 0.768 . . . . 0.0 111.575 176.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.8 ttm -152.49 142.45 22.16 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.409 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 9.1 t -164.27 145.13 8.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.5 t 35.96 90.47 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -83.19 178.31 28.84 Favored 'Cis proline' 0 CA--C 1.498 -1.297 0 C-N-CA 132.302 2.209 . . . . 0.0 108.755 -4.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 47.2 t -105.94 97.6 7.4 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.084 0 O-C-N 121.397 -0.814 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.3 t . . . . . 0 N--CA 1.501 2.081 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.503 HG23 ' HA ' ' A' ' 6' ' ' TYR . 97.7 m -83.42 117.69 23.22 Favored 'General case' 0 C--O 1.2 -1.501 0 O-C-N 121.375 -0.828 . . . . 0.0 110.23 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -138.97 -46.31 0.48 Allowed 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 174.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.81 -60.84 1.76 Allowed 'General case' 0 C--O 1.188 -2.173 0 CA-C-O 122.056 0.931 . . . . 0.0 111.46 -173.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.16 35.41 5.0 Favored Glycine 0 N--CA 1.473 1.154 0 O-C-N 121.03 -1.044 . . . . 0.0 111.234 -170.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG23 ' A' ' 2' ' ' THR . 9.8 t80 62.43 -64.49 0.09 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.668 1.587 . . . . 0.0 114.028 -177.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -87.04 14.72 6.99 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.706 -1.246 . . . . 0.0 112.017 -178.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 49.2 tpp -154.73 152.16 29.57 Favored 'General case' 0 C--O 1.283 2.831 0 O-C-N 121.617 -0.677 . . . . 0.0 111.052 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 21.3 t -106.3 -53.81 2.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 176.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -144.33 160.68 47.74 Favored Pre-proline 0 C--O 1.215 -0.753 0 N-CA-C 105.257 -2.127 . . . . 0.0 105.257 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -73.64 150.9 96.33 Favored 'Cis proline' 0 C--N 1.372 1.805 0 O-C-N 123.147 1.077 . . . . 0.0 111.075 -5.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -136.72 -69.17 0.47 Allowed 'General case' 0 C--O 1.215 -0.712 0 O-C-N 124.415 1.072 . . . . 0.0 111.187 -179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.394 0 O-C-N 121.107 -0.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.508 2.451 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.025 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 41.7 p -73.03 159.82 33.04 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -137.93 -19.31 1.16 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -179.212 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 35.7 t -147.32 149.84 33.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 57.11 -149.23 31.34 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -75.54 -39.74 57.88 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 123.075 1.417 . . . . 0.0 112.573 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.27 15.11 1.14 Allowed 'General case' 0 C--O 1.211 -0.967 0 N-CA-C 116.312 1.968 . . . . 0.0 116.312 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.3 mmt -81.77 -176.87 6.31 Favored 'General case' 0 C--O 1.242 0.686 0 O-C-N 120.592 -1.318 . . . . 0.0 107.82 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 15.9 t -150.62 179.65 8.0 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 104.006 -2.59 . . . . 0.0 104.006 175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 22.0 m -68.45 145.65 97.37 Favored Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 119.046 0.839 . . . . 0.0 112.416 -173.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -66.21 143.32 61.85 Favored 'Cis proline' 0 CA--C 1.536 0.614 0 C-N-CA 131.759 1.983 . . . . 0.0 110.793 2.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.22 137.72 54.81 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 -173.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.096 0 O-C-N 119.056 -2.277 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -81.55 157.5 24.77 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 8' ' ' MET . 9.3 t -158.03 -154.95 0.47 Allowed 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 72.2 m -62.68 150.86 39.86 Favored 'General case' 0 C--O 1.261 1.666 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 173.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 66.49 -145.49 47.31 Favored Glycine 0 C--O 1.211 -1.301 0 N-CA-C 105.035 -3.226 . . . . 0.0 105.035 -172.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -79.18 -44.96 20.87 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 164.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.15 134.5 14.27 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 103.742 -2.688 . . . . 0.0 103.742 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.495 ' H ' ' HB3' ' A' ' 3' ' ' CYS . 17.4 ttt -166.05 44.51 0.07 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -88.16 73.92 8.89 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 122.555 1.169 . . . . 0.0 112.191 -175.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -77.86 -11.06 0.17 Allowed Pre-proline 0 CA--C 1.581 2.166 0 N-CA-C 119.451 3.13 . . . . 0.0 119.451 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.37 150.04 87.36 Favored 'Cis proline' 0 N--CA 1.488 1.198 1 C-N-CA 137.469 4.362 . . . . 0.0 115.649 2.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.1 t -79.26 125.62 29.71 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.237 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.396 0 O-C-N 122.318 -0.239 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.19 -2.075 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.8 p -71.88 146.24 48.02 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.791 0.723 . . . . 0.0 110.081 -175.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 9' ' ' CYS . 14.1 m -126.83 -130.04 0.23 Allowed 'General case' 0 CA--C 1.565 1.552 0 O-C-N 123.869 0.731 . . . . 0.0 110.777 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.9 p -58.97 123.49 16.74 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 71.64 12.95 74.46 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 120.932 -1.105 . . . . 0.0 115.182 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 64.1 142.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.74 1.216 . . . . 0.0 113.518 -175.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.32 -44.87 0.07 Allowed 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 127.912 2.485 . . . . 0.0 115.888 -174.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 60.3 ttp -68.27 152.24 45.74 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 125.81 1.644 . . . . 0.0 108.578 175.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 10.7 t -156.14 -51.9 0.08 Allowed 'General case' 0 C--O 1.207 -1.169 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.3 t -139.33 111.95 7.85 Favored Pre-proline 0 N--CA 1.484 1.243 0 CA-C-O 116.853 -1.546 . . . . 0.0 108.96 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -74.91 163.7 90.04 Favored 'Cis proline' 0 CA--C 1.553 1.436 0 O-C-N 124.744 1.918 . . . . 0.0 115.091 -5.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.5 m -92.19 115.62 28.23 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 106.611 -1.625 . . . . 0.0 106.611 172.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.044 0 CA-C-N 116.103 -0.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_